Compound Name

SMILES String

CC#CC1(O)CCC2C3CCC4=CC(=O)CCC4=C3C(CC12C)c1ccc(cc1)N(C)C |c:18,t:11|

CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc(cc1)N(C)CCO[C@H]1CCC2C(C1)C[C@@H](O)C1C3CCC(C(C)CCC(O)=O)C3[C@@H](O)CC21 |r,c:18,t:11|

CC(=C)C[C@@](O)([C@@H](Nc1cccc2c1cc[nH]c2=O)c1cc(Br)ccc1O)C(F)(F)F |r|

CC(=O)C1=C(C)NC(C)=C([C@@H]1c1cccc2c1oc(C)cc2=O)C(=O)OC1CCC1 |r,c:3,8|

CC(=O)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4(C)[C@H]3CCC12C(=O)[CH-][N+]#N |r,t:10|

CC(=O)NCCn1nc(C)c(c1-c1ccc(F)cc1)-c1ccc2OCC(=O)Nc2c1

CC(=O)Nc1ccc(cc1)C(C)(C)c1ccccc1

CC(=O)Oc1cc2CCCCCCCCCCOC(=O)c2c(OC(C)=O)c1

CC(=O)Oc1cc2CCCCCCCCCOC(=O)c2c(OC(C)=O)c1

CC(=O)Oc1cc2CCCCCCCCOC(=O)c2c(OC(C)=O)c1

CC(=O)Oc1cc2CCCCCCCOC(=O)c2c(OC(C)=O)c1

CC(=O)Oc1ccc(CCc2cc(C)c3OCC(=O)Nc3c2)c(C)c1

CC(=O)Oc1ccc(CCc2ccc3OCC(=O)Nc3c2)c(C)c1

CC(=O)S[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]2CC[C@@]3(C)[C@@H](CC[C@@]33CCC(=O)O3)[C@H]12 |r,t:6|

CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C |r,t:10|

CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](C[C@]12C)N=[N+]=[N-] |r,t:10|

CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](C[C@]12C)NC[C@@H](N)C(O)=O |r,t:10|

CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](C[C@]12C)NS(=O)(=O)c1ccccc1[N+]([O-])=O |r,t:10|

CC(=O)c1ccc(cc1)N(Cc1ccccc1)c1ccc(NS(C)(=O)=O)cc1

CC(C)(C)NC(=O)NCC(C)(C)[C@@H](c1ccccc1)c1ccc2n(ncc2c1)-c1ccc(F)cc1 |r|

CC(C)(C)O\N=C1/CC(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(Cl)c[nH]c12 |(33.41,-19.38,;32.08,-20.14,;30.75,-19.36,;32.06,-18.6,;32.07,-21.68,;30.73,-22.44,;30.72,-23.97,;32.06,-24.76,;32.04,-26.3,;33.36,-25.52,;33.36,-27.06,;30.7,-27.06,;29.38,-26.28,;28.05,-27.03,;26.73,-26.26,;25.39,-27.03,;26.73,-24.73,;28.06,-23.96,;28.06,-22.42,;29.39,-24.74,;25.41,-23.95,;25.41,-22.41,;24.07,-21.63,;22.74,-22.41,;22.73,-23.95,;21.58,-24.98,;20.25,-24.21,;22.21,-26.39,;23.75,-26.23,;24.07,-24.72,)|

CC(C)(C)c1ccc(CC(O)(CC(C)(C)c2ccccc2)C(=O)Nc2ccc3C(=O)OCc3c2)cc1

CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F)c1cc(F)ccc1O

CC(C)(CC(O)(C(=O)Nc1ccc2C(=O)OCc2c1)C(F)(F)F)c1ccccc1

CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1cc(F)ccc1O

CC(C)(CC(O)(CC1CCCCC1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1

CC(C)(CC(O)(CNc1cccc2c1cc[nH]c2=O)C(F)(F)F)c1cccc(F)c1O

CC(C)(CC(O)(CNc1cccc2ccccc12)C(F)(F)F)c1cc(F)ccc1O

CC(C)(CC(O)(CNc1cccc2ncccc12)C(F)(F)F)c1cc(F)ccc1O

CC(C)(CC(O)(Cc1cc2cc(ccc2[nH]1)C#N)C(F)(F)F)c1cc(cc2CCOc12)S(C)(=O)=O

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)N1CCOCC1)C(F)(F)F)c1ccc(F)cc1

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)N1CCOCC1)C(F)(F)F)c1cccc(F)c1

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)N1CCOCC1)C(F)(F)F)c1cccc(O)c1

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)N1CCOCC1)C(F)(F)F)c1cccc(c1)C(N)=O

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)N1CCOCC1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)N1CCOCC1)C(F)(F)F)c1cccc(c1)S(N)(=O)=O

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)N1CCOCC1)C(F)(F)F)c1ccccc1

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)N1CCOCC1)C(F)(F)F)c1ccccc1C(N)=O

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)N1CCOCC1)C(F)(F)F)c1ccccc1S(C)(=O)=O

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)N1CCOCC1)C(F)(F)F)c1ccccc1S(N)(=O)=O

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)S(C)(=O)=O)C(F)(F)F)c1ccc(Cl)cc1C(N)=O

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)S(C)(=O)=O)C(F)(F)F)c1ccc(F)cc1C(N)=O

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)S(C)(=O)=O)C(F)(F)F)c1cccc2CCS(=O)(=O)c12

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)S(C)(=O)=O)C(F)(F)F)c1ccccc1C(N)=O

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)S(C)(=O)=O)C(F)(F)F)c1ccccc1S(C)(=O)=O

CC(C)(CC(O)(Cc1cc2cc(ncc2[nH]1)S(C)(=O)=O)C(F)(F)F)c1ccccc1S(N)(=O)=O

CC(C)(CC(O)(Cc1cc2ccc(cc2[nH]1)C#N)C(F)(F)F)c1cc(cc2CCOc12)S(C)(=O)=O

CC(C)(CC(O)(Cc1cc2ccccc2[nH]1)C(F)(F)F)c1cc(Br)cc2CCOc12

CC(C)(CC(O)(Cc1cc2ccccc2[nH]1)C(F)(F)F)c1cc(F)cc2CCOc12

CC(C)(CC(O)(Cc1cc2ccccc2[nH]1)C(F)(F)F)c1cc(cc2CCOc12)C#N

CC(C)(CC(O)(Cc1cc2ccccc2[nH]1)C(F)(F)F)c1cc(cc2CCOc12)S(C)(=O)=O

CC(C)(CC(O)(Cc1cc2ccccc2[nH]1)C(F)(F)F)c1cccc2CCOc12

CC(C)(CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(Cl)cc2CCOc12

CC(C)(CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)cc2CCOc12

CC(C)(CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(ccc1O)-c1ccccc1

CC(C)(CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(ccc1O)-c1cccnc1

CC(C)(CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(ccc1O)-c1cncnc1

CC(C)(CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cccc(F)c1

CC(C)(CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cccc2CCOc12

CC(C)(CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1ccccc1

CC(C)(CC(O)(Cc1cc2ncncc2[nH]1)C(F)(F)F)c1cc(Cl)cc2CCOc12

CC(C)(CC(O)(Cc1cc2ncncc2[nH]1)C(F)(F)F)c1cc(F)cc2CCOc12

CC(C)(CC(O)(Cc1cc2ncncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O

CC(C)(CC(O)(Cc1cc2ncncc2[nH]1)C(F)(F)F)c1ccc(F)cc1O

CC(C)(CC(O)(Cc1cc2ncncc2[nH]1)C(F)(F)F)c1cccc(c1)S(C)(=O)=O

CC(C)(CC(O)(Cc1cc2ncncc2[nH]1)C(F)(F)F)c1ccccc1S(C)(=O)=O

CC(C)(CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1cc(F)ccc1O

CC(C)(CC(O)(Cc1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1)c1ccccc1

CC(C)(CC(O)(Cn1ccc(=O)c2ccccc12)C(F)(F)F)c1cc(F)ccc1O

CC(C)(CC(O)(Cn1ccc(=O)c2ccccc12)C(F)(F)F)c1ccc(F)cc1O

CC(C)(CC(O)(Cn1ccc(=O)c2ccccc12)C(F)(F)F)c1cccc2CCOc12

CC(C)(CC(O)(Cn1ccc(=O)c2ccccc12)C(F)(F)F)c1ccccc1

CC(C)(CC(O)(Cn1ccc(=O)c2ccccc12)C(F)(F)F)c1ccccc1O

CC(C)(CNC(=O)CC(F)(F)F)[C@@H](c1ccccc1)c1ccc2n(ncc2c1)-c1ccc(F)cc1 |r|

CC(C)(CNS(=O)(=O)CC(F)(F)F)[C@@H](c1ccccc1)c1ccc2n(ncc2c1)-c1ccc(F)cc1 |r|

CC(C)(CO)[C@H]1Nc2ccc(cc2[C@H]2C=CC[C@@H]12)[N+]([O-])=O |r,c:15|

CC(C)(C[C@@](O)(Cc1cc2ccc(cc2[nH]1)C#N)C(F)(F)F)c1cc(cc2CCOc12)S(C)(=O)=O |r|

CC(C)(C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)c1cc(F)ccc1O |r|

CC(C)(C[C@@](O)(Cc1cc2cnccc2[nH]1)C(F)(F)F)c1cc(F)ccc1O |r|

CC(C)(C[C@](O)(Cc1cc2ccc(cc2[nH]1)C#N)C(F)(F)F)c1cc(cc2CCOc12)S(C)(=O)=O |r|

CC(C)(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1c(N)cc(Cl)cc1Cl

CC(C)([C@@H](c1ccccc1)c1ccc(O)c(Br)c1)C(=O)Nc1nccs1 |r|

CC(C)([C@@H](c1ccccc1)c1ccc(O)c(F)c1)C(=O)Nc1nccs1 |r|

CC(C)([C@@H](c1ccccc1)c1ccc(O)c(F)c1)C(=O)Nc1nncs1 |r|

CC(C)([C@@H](c1ccccc1)c1ccc(O)cc1)C(=O)Nc1nccs1 |r|

CC(C)([C@@H](c1ccccc1)c1ccc2n(ncc2c1)-c1ccc(F)cc1)C(=O)Nc1nncs1 |r|

CC(C)([C@@H]1c2ccc(nc2Oc2c(F)cccc12)-c1ccc(cc1)C(=O)N1CCOCC1)C(=O)NC(N)=O |r|

CC(C)([C@@H]1c2ccc(nc2Oc2c(F)cccc12)-c1ccc(cc1)C(=O)N1CCOCC1)C(=O)Nc1nncs1 |r|

CC(C)([C@H](c1ccccc1)c1ccc2n(ncc2c1)-c1ccc(F)cc1)C(=O)Nc1nncs1 |r|

CC(C)([C@H]1c2ccccc2Oc2cc(O)ccc12)C(=O)Nc1nccs1 |r|

CC(C)([C@H]1c2ccccc2Oc2cc(O)ccc12)C(=O)Nc1nncs1 |r|

CC(C)(c1ccccc1)c1ccc(NS(=O)(=O)C(F)(F)F)cc1

CC(C)(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1

CC(C)(c1ccccc1)c1ccc(cc1)S(N)(=O)=O

CC(C)(c1ccccc1)c1cccc(NS(C)(=O)=O)c1

CC(C)C(=O)O[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C)C(=O)CO |r,t:13|

CC(C)C(O)(CC(C)(C)c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1

CC(C)C1CC(=NN1c1ccc(C#N)c(Cl)c1)c1ccc(cc1)C(O)=O |c:5|

CC(C)CC1CC(=NN1c1ccc(cc1)C#N)c1ccc(cc1)C(O)=O |c:6|

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(O)=O |r|

CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(O)=O |r|

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(O)=O |r|

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(O)=O |r|

CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@H](C)O)C(=O)N[C@@H]([C@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(O)=O |r|

CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|

CC(C)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2CCC(=O)Nc2c1 |r|

CC(C)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CC(C)Cc1cc2N([C@@H](CC(N)=O)COc2cc1Cl)C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CC(C)Cc1cc2N([C@@H](CS(N)(=O)=O)COc2cc1F)C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CC(C)Cn1nc(C)c(c1-c1ccc(F)cc1)-c1ccc2OCC(=O)Nc2c1

CC(C)NC(=O)O[C@@H]1[C@@H](C)c2c(NC1(C)C)cc(F)c(c2F)-c1cccc2c(Cl)c[nH]c12 |r,wU:7.6,wD:8.8,(8.71,-22.74,;7.37,-23.51,;7.37,-25.05,;6.04,-22.73,;4.7,-23.5,;4.7,-25.04,;3.37,-22.73,;2.04,-23.49,;.7,-22.71,;.7,-21.17,;-.64,-23.49,;-.64,-25.04,;.69,-25.81,;2.03,-25.04,;3.57,-25.04,;2.02,-26.58,;-1.97,-25.81,;-3.3,-25.04,;-4.64,-25.81,;-3.3,-23.5,;-1.97,-22.73,;-1.98,-21.19,;-4.63,-22.73,;-4.63,-21.19,;-5.96,-20.42,;-7.3,-21.19,;-7.29,-22.74,;-8.42,-23.78,;-9.93,-23.47,;-7.78,-25.17,;-6.26,-25,;-5.96,-23.5,)|

CC(C)OC(=O)C1=C(C)NC(C)=C(C#N)C1c1cccc2C(=O)c3ccccc3-c12 |c:6,t:11|

CC(C)OC(=O)C1=C(C)NC(C)=C(C#N)C1c1cccc2c1oc(C)cc2=O |c:6,t:11|

CC(C)OC(=O)C1=C(C)NC(C)=C(C1c1cccc2c1oc(C)cc2=O)C(=O)C(F)(F)F |c:6,11|

CC(C)OC(=O)C1=C(C)NC(C)=C(C1c1cccc2c1oc(C)cc2=O)C(C)=O |c:6,11|

CC(C)O\N=C1/CC(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(C)c[nH]c12 |(2.4,-30.12,;1.06,-30.88,;-.26,-30.1,;1.05,-32.41,;-.28,-33.17,;-.29,-34.71,;1.04,-35.49,;1.03,-37.04,;2.35,-36.26,;2.35,-37.8,;-.32,-37.79,;-1.64,-37.01,;-2.97,-37.77,;-4.29,-37,;-5.62,-37.76,;-4.28,-35.46,;-2.96,-34.69,;-2.95,-33.16,;-1.63,-35.47,;-5.61,-34.69,;-5.61,-33.14,;-6.94,-32.37,;-8.27,-33.14,;-8.28,-34.68,;-9.43,-35.71,;-10.77,-34.94,;-8.8,-37.13,;-7.27,-36.96,;-6.94,-35.45,)|

CC(C)S(=O)(=O)c1cc2cc(CC(O)(CC(C)(C)c3ccc(F)cc3C(N)=O)C(F)(F)F)[nH]c2cn1

CC(C)[C@@H]1CN(CCN1c1ncc(CO)c(n1)C(F)(F)F)c1ccc(CO)c(c1)S(C)(=O)=O |r|

CC(C)[C@H](NC(=O)C(C)(F)F)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(=O)n(C)c1)c1ccccc1 |r|

CC(C)c1cc(-c2ccc3OCC(=O)Nc3c2)n(n1)-c1ccc(F)cc1

CC(C)c1ncc2[nH]c(CC(O)(CC(C)(C)c3cc(F)ccc3C)C(F)(F)F)cc2n1

CC(C)c1onc(c1COc1ccc(N(C)Cc2ccc(cc2)C(O)=O)c(n1)C(F)(F)F)-c1c(Cl)cccc1Cl |(29.01,-37.57,;28.39,-38.98,;26.86,-39.15,;29.3,-40.22,;30.85,-40.22,;31.33,-41.69,;30.08,-42.6,;28.83,-41.7,;27.5,-42.46,;26.16,-41.7,;24.83,-42.47,;23.48,-41.71,;22.16,-42.49,;22.17,-44.02,;20.84,-44.79,;20.84,-46.33,;19.5,-44.03,;18.17,-44.8,;18.18,-46.35,;16.84,-47.12,;15.5,-46.35,;15.51,-44.81,;16.84,-44.04,;14.17,-47.12,;12.84,-46.35,;14.17,-48.66,;23.5,-44.79,;24.83,-44.01,;23.5,-46.33,;22.17,-47.1,;24.84,-47.1,;23.49,-47.86,;30.09,-44.13,;31.42,-44.89,;32.75,-44.11,;31.43,-46.43,;30.1,-47.21,;28.76,-46.45,;28.75,-44.91,;27.42,-44.14,)|

CC(C)n1cc(-c2ccc(C#N)c(C)c2)c2ccc(NS(C)(=O)=O)cc12

CC(C)n1cc(-c2ccc(C#N)c(F)c2)c2ccc(NS(C)(=O)=O)cc12

CC(C)n1cc(-c2ccc(cc2)C#N)c2ccc(NS(C)(=O)=O)cc12

CC(C)n1nccc1-c1ccnc(NC(N)=O)c1

CC(CCC(O)=O)C1CC[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(OC(C)=O)C(C)(C)[C@@H]1CC3=O |c:12|

CC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1c(C)cc(C)cc1C |w:1.0|

CC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl |w:1.0|

CC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1c(Cl)cccc1Cl |w:1.0|

CC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1c(N)cc(Cl)cc1Cl

CC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C |w:1.0|

CC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1cc(Cl)c(Cl)cc1Cl |w:1.0|

CC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(Cl)cc1Cl |w:1.0|

CC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(cc1)C(C)(C)C |w:1.0|

CC(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(cc1)C(C)C |w:1.0|

CC(Cc1ccnc(NC(N)=O)c1)c1ccccc1

CC(Cc1ccnc(NC(N)=O)c1)c1ccccc1C

CC(N(CC(F)(F)F)c1ccc(C#N)c(c1)C(F)(F)F)C(=O)N(C)C

CC(O)(CC(C)(C)c1ccccc1)C(=O)Nc1ccc2C(=O)OCc2c1

CC(O)(CS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(C#N)c(c1)C(F)(F)F

CC(O)(Cc1ccnc(NC(N)=O)c1)c1ccccc1

CC1(C)CCc2cc3c(cc(=O)oc3cc2N1)C(F)(F)F

CC1(C)CN([C@@H](CO1)c1ccccc1)c1ccc2OCC(=O)Nc2n1 |r|

CC1(C)CN(c2ccc(F)cc2)c2ccc(NS(C)(=O)=O)cc2O1

CC1(C)C[C@@](O)([C@@H](Nc2cccc3[nH]c(=O)ccc23)c2ccc(F)c(O)c12)C(F)(F)F |r|

CC1(C)C[C@@](O)([C@@H](Nc2cccc3c2cc[nH]c3=O)c2ccc(F)c(O)c12)C(F)(F)F |r|

CC1(C)Nc2c3CCCc3c(cc2C(C)(C)C1=O)-c1cccc2nccn12

CC1(C)Nc2c3CCCc3c(cc2C(C)(C)C1=O)-c1cccc2nncn12

CC1(C)Nc2c3CCCc3c(cc2C(C)(C)C1=O)-c1ccnc2ncccc12

CC1(C)Nc2c3CCCc3c(cc2C(C)(C)C1=O)-c1cncc2nccn12

CC1(C)Nc2ccc(cc2C(C)(C)C1=O)-c1csc(c1)C#N

CC1(C)OC(=O)C(=C1c1ccc2OCC(=O)Nc2c1)c1ccc(F)cc1 |c:6|

CC1(C)OC(=O)Nc2ccc(cc12)-c1cc(F)cc(c1)C#N

CC1(C)OC(=O)Nc2ccc(cc12)-c1ccc(F)c(Cl)c1

CC1(C)OC(=O)Nc2ccc(cc12)-c1coc(c1)C#N

CC1(C)OC(=O)Nc2ccc(cc12)-c1csc(c1)C#N

CC1(C)OC(=S)Nc2ccc(NS(=O)(=O)c3cccs3)cc12

CC1(C)OCC(=O)Nc2ccc(cc12)-c1cc(F)cc(c1)C#N

CC1(C)Oc2cc(NS(C)(=O)=O)ccc2C(=N1)c1ccc(Cl)cc1 |c:16|

CC1(C)Oc2cc(NS(C)(=O)=O)ccc2N(C1=O)c1ccc(F)cc1

CC1(F)OC(=O)C(=C1c1ccc2OCC(=O)Nc2c1)c1ccc(F)cc1 |c:6|

CC1(Sc2nncn2N=C1c1ccc2OCC(=O)Nc2c1)c1ccccc1 |c:9|

CC12CCC3C(CCC4=CC(=O)CCC34C)C1CCC2C(=O)[CH-][N+]#N |t:8|

CC1=C(c2ccc(F)cc2)c2ccc(NS(C)(=O)=O)cc2OC1(C)C |c:1|

CC1=CC(=C)C(Cc2ccc(cc2)[N+]([O-])=O)C(C)(C)C1 |t:1|

CC1=CC(C)(C)Nc2cc3oc(=O)cc(c3cc12)C(F)(F)F |t:1|

CC1=CC(C)(C)Nc2ccc(cc12)-c1cc(F)cc(c1)C#N |t:1|

CC1=CC(C)(C)Nc2ccc(cc12)-c1csc(c1)C#N |t:1|

CC1=CC(C)(C)Nc2ccc-3c(COc4ccc(F)cc-34)c12 |t:1|

CC1=CC(C)(C)Nc2ccc-3c(COc4ccc(cc-34)[N+]([O-])=O)c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4cc(Cl)ccc4OC(c4ccccc4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4cc(F)ccc4O\C(=C/Br)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4cc(F)ccc4O\C(=C/c4ccncc4C)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4cc(F)ccc4O\C(=C/c4ccsc4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4cccc(F)c4O\C(=C/c4ccccc4C)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4cc(C)cc(Br)c4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4cc(Cl)cc(Cl)c4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4ccc(Br)cc4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4ccc(C)c(F)c4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4ccc(C)cc4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4ccc(Cl)c(C)c4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4ccc(Cl)c(Cl)c4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4ccc(Cl)c(F)c4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4ccc(Cl)cc4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4cccc(Br)c4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4cccc(Cl)c4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4cccc(c4)C(F)(F)F)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4OC(c4ccccc4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4O\C(=C/c4cc(F)ccc4F)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4O\C(=C/c4ccc(F)c(F)c4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4O\C(=C/c4cccc(F)c4)c3c12 |t:1|

CC1=CC(C)(C)Nc2ccc3-c4ccccc4O\C(=C/c4ccccc4)c3c12 |t:1|

CC1=C[C@H](CCC1)[C@@H]1Oc2c(F)cc(F)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |r,t:1,27|

CC1=NC(C)=C(C(=O)OC(C)(C)C)C(C)(C1C#N)c1ccc(F)cc1 |t:1,4|

CC1=NC(C)=C(C(C1C#N)c1ccc(F)cc1)C(=O)OC(C)(C)C |c:4,t:1|

CC1=NC(C)=C(C(C1C#N)c1ccc(F)cc1F)C(=O)OC(C)(C)C |c:4,t:1|

CC1=NC(C)=C([C@@H](C1C#N)c1ccc(F)cc1Cl)C(=O)OC(C)(C)C |r,c:4,t:1|

CC1=NC(C)=C([C@H](C1C#N)c1ccc(F)cc1Cl)C(=O)OC(C)(C)C |r,c:4,t:1|

CC1CC(C)(C)Nc2c(C)cc(c(Cl)c12)-c1cc(F)c(F)c2cc[nH]c12 |w:1.0|

CC1CC(C)(C)Nc2c(C)cc(c(Cl)c12)-c1ccc(F)c2cc[nH]c12 |w:1.0|

CC1CC(C)(C)Nc2c(C)cc(c(Cl)c12)-c1cccc2cc[nH]c12 |w:1.0|

CC1CC(C)(C)Nc2ccc(cc12)-c1sc(cc1C)C#N

CC1CCNc2cc3oc(=O)cc(c3cc12)C(F)(F)F

CC1CCc2ccccc2N1C(=O)c1ccc2OCC(=O)Nc2c1

CC1CCc2ccccc2N1S(=O)(=O)c1ccc2OCC(=O)Nc2c1

CC1N(C)C(=O)C(=C1c1ccc2OCC(=O)Nc2c1)c1ccc(F)cc1 |c:6|

CC1N(C2CC2)C(=O)C(=C1c1ccc2OCC(=O)Nc2c1)c1ccc(F)cc1 |c:9|

CC1N(CCO)C(=O)C(=C1c1ccc2OCC(=O)Nc2c1)c1ccc(F)cc1 |c:8|

CC1NC(=O)C(=C1c1cc(C)c2OCC(=O)Nc2c1)c1ccc(F)cc1 |c:5|

CC1NC(=O)C(=C1c1cc(Cl)c2OCC(=O)Nc2c1)c1ccc(F)cc1 |c:5|

CC1NC(=O)C(=C1c1cc(F)c2OCC(=O)Nc2c1)c1ccc(F)cc1 |c:5|

CC1NC(=O)C(=C1c1ccc2OCC(=O)Nc2c1)c1ccc(F)cc1 |c:5|

CC1OC(=O)C(=C1c1ccc2OCC(=O)Nc2c1)c1ccc(F)cc1 |c:5|

CC1Oc2cc(NS(C)(=O)=O)ccc2N(C1=O)c1ccc(F)cc1

CC=C1C(=O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |w:1.0,t:10|

CCC(=O)O[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C)C(=O)CO |r,t:12|

CCC(=O)O[C@@]1([C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)SCF |r,c:18,t:14|

CCC(=O)Oc1cc2CCCCCCC[C@@H](C)OC(=O)c2c(OC(=O)CC)c1 |r|

CCC(C(=O)OC)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12

CCC(C)(C)C(O)(Cc1cc2ccncc2[nH]1)CC(C)(C)c1cc(F)ccc1OC

CCC(CC)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12

CCC(CC)(c1ccc(Cl)cc1)n1ncc2c(NS(C)(=O)=O)cccc12

CCC(CC)(c1cnc2c(NS(C)(=O)=O)cccn12)c1ccc(Cl)cc1

CCC(CC)(c1nnc2c(NS(C)(=O)=O)cccn12)c1ccc(Cl)cc1

CCC(CO)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cc(Br)cc12

CCC(CO)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cc(cc12)C#N

CCC(Cc1c(C)cccc1C)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1cc(C)c(O)c(C)c1)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1cc(C)c(OC)c(C)c1)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1cc(C)cc(C)c1)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1cc(C)ccc1C)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1cc(Cl)cc(Cl)c1)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1cc(F)cc(F)c1)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1ccc(C)cc1)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1ccc(C)cc1C)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1ccc(O)c(C)c1C)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1ccc(O)c2ccccc12)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1ccc(OC)c(C)c1C)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1ccc2ccccc2c1)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1cccc(C)c1)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1cccc(C)c1C)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1cccc2ccccc12)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(Cc1ccccc1C)NS(=O)(=O)c1c(C)cc(C)cc1C

CCC(O)(Cc1cc2ccncc2[nH]1)CC(C)(C)c1cc(F)ccc1OC

CCC1(OCC(=O)Nc2ccc(cc12)-c1cc(F)cc(c1)C#N)c1ccco1

CCC1=C(C(C(C#N)C(C)=N1)c1ccccc1Cl)C(=O)OC |c:9,t:2|

CCC1CCNc2cc3oc(=O)cc(c3cc12)C(F)(F)F

CCC1Nc2cc3oc(=O)cc(c3cc2CC1C)C(F)(F)F

CCC1OC(=O)C(=C1c1ccc2OCC(=O)Nc2c1)c1ccc(F)cc1 |c:6|

CCCC(=O)O[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C)C(=O)CO |r,t:13|

CCCC1=C(C(C(C#N)C(C)=N1)c1ccc(F)cc1Cl)C(=O)OC |c:10,t:3|

CCCC1=C(C(C(C#N)C(C)=N1)c1ccccc1)C(=O)OC |c:10,t:3|

CCCC1=C(C(C(C#N)C(C)=N1)c1ccccc1Cl)C(=O)OC |c:10,t:3|

CCCC1=C([C@@H](C(C#N)C(C)=N1)c1ccnc2ccccc12)C(=O)OCC |r,c:10,t:3|

CCCC1=C([C@H](C(C#N)C(C)=N1)c1ccnc2ccccc12)C(=O)OCC |r,c:10,t:3|

CCCC1CCNc2cc3oc(=O)cc(c3cc12)C(F)(F)F

CCCC1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO |r,c:15,t:11|

CCCC1Sc2nncn2N=C1c1ccc2OCC(=O)Nc2c1 |c:11|

CCCCC1=C(C(C(C#N)C(C)=N1)c1ccccc1Cl)C(=O)OC |c:11,t:4|

CCCCCC(=O)O[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C)C(=O)CO |r,t:15|

CCCCCCC(=O)O[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C)C(=O)CO |r,t:16|

CCCCn1nc(C)c(c1-c1ccc(F)cc1)-c1ccc2OCC(=O)Nc2c1

CCCn1nc(C)c(c1-c1ccc(F)cc1)-c1ccc2OCC(=O)Nc2c1

CCCn1nccc1-c1ccnc(NC(N)=O)c1

CCN(C)C(=O)c1ccc(cc1F)-c1ccc2[C@@H](c3ccccc3Oc2n1)C(C)(C)C(=O)Nc1nncs1 |r|

CCN(C[C@](O)(CNC(=O)c1cnn(c1N)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1c(Cl)cccc1Cl |r|

CCN(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1

CCN1C(C)=C(C#N)C(C(C(=O)OC(C)(C)C)=C1C)c1ccc(F)cc1F |c:16,t:4|

CCN1C(C)C(=C(C1=O)c1ccc(F)cc1)c1ccc2OCC(=O)Nc2c1 |c:5|

CCNC(=O)CC1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1

CCOC(=O)C1=C(C)N=C(C)C([C@H]1c1cccc2c1oc(C)cc2=O)C(C)=O |r,c:5,t:8|

CCOC(=O)C1=C(N=C(C)C(C#N)C1c1ccccc1Cl)c1ccc(Cl)cc1 |t:5,7|

CCOC(=O)C1=C(N=C(C)C(C#N)C1c1ccccc1Cl)c1ccccc1 |t:5,7|

CCOC(=O)c1ccc(cc1)N1N=C(CC1c1ccc(F)cc1)c1ccc(cc1)C(O)=O |c:13|

CCOC(=O)c1cccc2n(ccc12)C(C(=O)OC)c1ccc(F)cc1Cl

CCOCc1cc(NC(=O)c2ccc(c(OC)c2)S(N)(=O)=O)ccc1-c1ccccc1C(F)(F)F

CCO\N=C1/C(O)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(C)c[nH]c12 |(18.93,7.26,;17.6,6.5,;17.59,4.96,;16.25,4.2,;16.24,2.67,;17.57,1.88,;18.91,2.64,;17.56,.34,;18.88,1.12,;18.88,-.43,;16.22,-.42,;14.9,.36,;13.57,-.4,;12.25,.37,;10.91,-.39,;12.25,1.91,;13.58,2.68,;13.58,4.21,;14.91,1.9,;10.93,2.69,;10.93,4.23,;9.59,5.01,;8.26,4.23,;8.25,2.69,;7.1,1.66,;5.77,2.43,;7.73,.25,;9.27,.41,;9.59,1.92,)|

CCOc1cc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:13|

CCOc1cc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1 |r,t:13|

CCOc1cccc2OC(c3ccccc3)c3cc(NS(C)(=O)=O)ccc3-c12

CCOc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:13|

CCOc1ncc(C)c2N=C(C)C([C@@H](c3ccc(cc3OC)C#N)c12)C(N)=O |r,t:9|

CCOc1ncc(C)c2NC(C)=C(C#N)[C@@H](c3ccc(cc3OC)C#N)c12 |r,t:11|

CCOc1nccc2NC(C)=C(C#N)C(c3ccc(cc3OC)C#N)c12 |t:10|

CCOc1nccc2NC(C)=C(C#N)[C@@H](c3ccc(cc3OC)C#N)c12 |r,t:10|

CCS(=O)(=O)Nc1ccc(cc1)C(C)(C)c1ccccc1

CCS(=O)(=O)c1cc2cc(CC(O)(CC(C)(C)c3ccc(F)cc3C(N)=O)C(F)(F)F)[nH]c2cn1

CCS(=O)(=O)c1cc2cc(CC(O)(CC(C)(C)c3ccccc3C(N)=O)C(F)(F)F)[nH]c2cn1

CCSC[C@@](O)([C@@H](Nc1cccc2nc(C)ccc12)c1ccc(OC)c(F)c1Cl)C(F)(F)F |r|

CC[C@@H](C)n1cc(-c2ccc(cc2)C#N)c2ccc(NS(C)(=O)=O)cc12 |r|

CC[C@@H](Cc1ccc(O)c(C)c1)NS(=O)(=O)c1c(C)cc(C)cc1C |r|

CC[C@@H](Cc1ccc(O)c(C)c1C)NS(=O)(=O)c1c(C)cc(C)cc1C |r|

CC[C@@H](Cc1ccc(O)cc1)NS(=O)(=O)c1c(C)cc(C)cc1C |r|

CC[C@@H](Cc1ccc(O)cc1C)NS(=O)(=O)c1c(C)cc(C)cc1C |r|

CC[C@@H](Cn1cc(C#N)c2ccccc12)NS(=O)(=O)c1c(N)cc(Cl)cc1Cl |r|

CC[C@@H](Cn1cc(C)c2ccccc12)NS(=O)(=O)c1c(N)cc(Cl)cc1Cl |r|

CC[C@@H](Cn1ccc2ccccc12)NS(=O)(=O)c1c(N)cc(Cl)cc1Cl |r|

CC[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2cc(OC)cc(OC)c2)C1=O)c1ccccc1 |r|

CC[C@@H]1CC2=CC(=O)CC[C@@H]2[C@H]2CC[C@@]3(C)[C@@H](CC[C@]33OCC=C3)[C@H]12 |r,c:24,t:4|

CC[C@@H]1CC2=CC(=O)CC[C@@H]2[C@H]2CC[C@@]3(CC)[C@@H](CC[C@]33OCC=C3)[C@H]12 |r,c:25,t:4|

CC[C@@H]1CNc2cc3oc(=O)cc(c3cc2[C@H]1CC)C(F)(F)F |r|

CC[C@@H]1C[C@@](O)([C@@H](Nc2cc(F)cc3nc(C)ncc23)c2ccc(F)c(O)c12)C(F)(F)F |r|

CC[C@@H]1C[C@@](O)([C@@H](Nc2cccc3[nH]c(=O)ccc23)c2cc(F)c(F)c(O)c12)C(F)(F)F |r|

CC[C@@H]1C[C@@](O)([C@@H](Nc2cccc3nc(C)ccc23)c2ccc(F)c(O)c12)C(F)(F)F |r|

CC[C@@H]1[C@H](C)CNc2cc3oc(=O)cc(c3cc12)C(F)(F)F |r|

CC[C@@](C(=O)OC)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12 |r|

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(O)=O |r|

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(O)=O |r|

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(O)=O |r|

CC[C@H](C)n1cc(-c2ccc(cc2)C#N)c2ccc(NS(C)(=O)=O)cc12 |r|

CC[C@H]1[C@@H](O)CC(=O)N1c1ccc(C#N)c(c1)C(F)(F)F |r|

CC[C@H]1[C@H](C)CNc2cc3oc(=O)cc(c3cc12)C(F)(F)F |r|

CC[C@](C(=O)NC(C)(C)C)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12 |r|

CC[C@](C(=O)NC)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12 |r|

CC[C@](C(=O)NCC(F)(F)F)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12 |r|

CC[C@](C(=O)OC)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12 |r|

CC[C@](C(C)O)(c1ccc(cc1)C(F)(F)F)n1ncc2c(NS(C)(=O)=O)cc(F)cc12 |r|

CC[C@](C(C)O)(c1ccc(cc1)C(F)(F)F)n1ncc2c(NS(C)(=O)=O)cccc12 |r|

CC[C@](CO)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cc(F)cc12 |r|

CC[C@](CO)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12 |r|

CC[C@](CO)(c1ccc(Cl)cc1)n1ncc2c(NS(C)(=O)=O)cccc12 |r|

CC[C@](c1noc(n1)-c1ccccc1)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12 |r|

CC[C@](c1noc(n1)C1CC1)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12 |r|

CC[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4C=C[C@H]3[C@@H]1CC[C@]21OCC=C1 |r,c:11,14,26|

CC[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4C[C@@H](C)[C@H]3[C@@H]1CC[C@]21OCC=C1 |r,c:11,27|

CC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@]21OCC=C1 |r,c:26,t:9|

CC[C@]12CC[C@H]3[C@@H](C[C@@H](CO)C4=CC(=O)CC[C@H]34)[C@@H]1CC[C@]21OCC=C1 |r,c:28,t:11|

CC\C(=C(\c1ccc(\C=C\C(O)=O)cc1)c1ccc2[nH]ncc2c1)c1ccc(F)cc1Cl

CC\C(c1cccc(NS(C)(=O)=O)c1)=C1/c2ccccc2OCc2cccc(OC)c12

CC\C(c1cccc(NS(C)(=O)=O)c1)=C1\c2ccccc2COc2ccccc12

CC\C=C(/C)c1ccsc1\C=C1/Oc2ccc(O)c(OC)c2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:32|

CCc1cc(-c2ccc3OCC(=O)Nc3c2)n(n1)-c1ccc(F)cc1

CCc1cccc2[nH]c(CC(O)(CC(C)(C)c3cc(F)ccc3OC)C(F)(F)F)cc12

CCc1ccccc1-n1nc(cc1-c1ccc2OCC(=O)Nc2c1)C(F)(F)F

CCc1ccccc1\C=C1/Oc2ccc(F)cc2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:28|

CCc1cn(CCO)c(CC)c1Oc1ccc(cc1)C#N

CCc1cnc2cccc(C3C(C#N)=C(C)NC(C)=C3C(=O)OC(C)C)c2c1 |c:18,t:13|

CCc1nn(C)c2ncc(C(=O)NCC3Cc4ccccc4C3)c(Cl)c12

CCn1cc(-c2ccc(cc2)C#N)c2ccc(NS(C)(=O)=O)cc12

CCn1cc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N([C@H](C)c3ccccc3)C2=O)cn1 |r|

CCn1nc(C)c(c1-c1ccc(F)cc1)-c1ccc2OCC(=O)Nc2c1

CCn1ncc2c(Cl)c(cnc12)C(=O)NCc1ccc(C)cc1C

CN(C(C)=O)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:27,34|

CN(C)C(=O)c1ccc(cc1)-c1ccc2[C@H](c3ccccc3Oc2n1)C(C)(C)C(=O)Nc1nncs1 |r|

CN(C)C(=O)c1ccc(cc1F)-c1ccc2[C@@H](c3ccccc3Oc2n1)C(C)(C)C(=O)Nc1nncs1 |r|

CN(C)CCN(C)C(=O)c1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)c1ccc(cc1)C#N |t:16|

CN(C)S(=O)(=O)Nc1ccc(cc1)C(C)(C)c1ccccc1

CN(C)[C@H]1C[C@H](Nc2ccc(cc12)[N+]([O-])=O)C(C)(C)CO |r|

CN(C)c1ccc(cc1)[C@H]1C[C@]2(C)[C@@H](CC[C@]2(O)CCCO)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:27,34|

CN(Cc1ccc(cc1)C(O)=O)c1ccc(OCc2c(onc2-c2c(Cl)cccc2Cl)C2CC2)nc1C(F)(F)F |(-1.96,-48.67,;-1.97,-47.13,;-3.3,-46.37,;-4.63,-47.14,;-4.63,-48.69,;-5.97,-49.46,;-7.3,-48.69,;-7.3,-47.15,;-5.97,-46.38,;-8.63,-49.46,;-9.97,-48.69,;-8.64,-51,;-.64,-46.36,;-.65,-44.83,;.68,-44.05,;2.02,-44.81,;3.36,-44.04,;4.7,-44.81,;6.02,-44.04,;6.49,-42.57,;8.04,-42.56,;8.53,-44.03,;7.28,-44.94,;7.28,-46.48,;8.62,-47.24,;9.94,-46.46,;8.63,-48.77,;7.29,-49.55,;5.96,-48.79,;5.95,-47.25,;4.61,-46.48,;5.58,-41.33,;5.41,-39.8,;4.17,-40.71,;2.03,-46.35,;.7,-47.13,;.7,-48.67,;-.63,-49.44,;2.03,-49.44,;.68,-50.21,)|

CN(Cc1cccc(c1)C(O)=O)c1ccc(OCc2c(onc2-c2c(Cl)cccc2Cl)C2CC2)nc1C(F)(F)F |(21.34,-24.3,;21.34,-22.76,;20,-21.99,;18.67,-22.77,;17.33,-22,;16,-22.77,;16,-24.32,;17.34,-25.09,;18.67,-24.32,;17.34,-26.63,;16,-27.4,;18.67,-27.4,;22.67,-21.98,;22.65,-20.45,;23.98,-19.67,;25.32,-20.44,;26.66,-19.66,;28,-20.43,;29.32,-19.66,;29.79,-18.19,;31.35,-18.19,;31.83,-19.65,;30.58,-20.57,;30.59,-22.1,;31.92,-22.86,;33.25,-22.08,;31.93,-24.4,;30.6,-25.18,;29.26,-24.41,;29.25,-22.87,;27.92,-22.11,;28.88,-16.95,;28.71,-15.42,;27.47,-16.33,;25.33,-21.98,;24,-22.75,;24,-24.29,;22.67,-25.06,;25.34,-25.06,;23.99,-25.83,)|

CN(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1

CN1CCN(CC1)n1c2ccc(\C=C3/c4ccccc4COc4cc(F)ccc34)cc2[nH]c1=NC#N

CN1CC[C@@H](C1)N(Cc1ccccc1C(F)(F)F)c1ccc(C#N)c(Cl)c1 |r|

CN1[C@@H]2CCCC[C@@H]2c2cc3c(cc(=O)n(C)c3cc12)C(F)(F)F

CN1[C@@H]2CC[C@H]3[C@@H]4C\C(=C/c5cncnc5)[C@H](O)[C@@]4(C)CC[C@@H]3[C@@]2(C)C=CC1=O |r,c:29|

CNC(=O)C[C@@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CNC(=O)C[C@H]1CCc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CNC(=O)C[C@H]1COc2cc(Br)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CNC(=O)C[C@H]1COc2cc(C)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CNC(=O)C[C@H]1COc2cc(Cl)cc(C)c2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CNC(=O)C[C@H]1COc2cc(Cl)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CNC(=O)C[C@H]1COc2cc(F)c(CC(C)C)cc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CNC(=O)C[C@H]1COc2cc(F)c(CC(C)C)cc2N1C(=O)c1ccnc(NC(N)=O)c1 |r|

CNC(=O)C[C@H]1COc2cc(F)c(OC(C)C)cc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CNC(=O)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2COC(=O)Nc2c1 |r|

CNC(=O)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CNC(=O)C[C@H]1COc2cc(ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1)C#N |r|

CNC(=O)C[C@H]1COc2cc(ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1)C(F)(F)F |r|

CNC(=O)C[C@H]1COc2ccc(Cl)cc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CNC(=O)C[C@H]1COc2ccccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CNC(=O)Cn1cc(C2CC2)c(Oc2ccc(cc2)C#N)c1C1CC1

CNC(=O)c1ccc(nc1OC)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:13|

CNC(=O)c1ccc(nc1OC)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)n1 |r,t:13|

CNC(=O)c1ccc2[nH]c(nc2c1)[C@@]1(Cc2ccccc2)OC(=O)N([C@H](C)c2ccc(F)cc2)C1=O |r|

CNC(=O)c1ccccc1C(C)(C)CC(O)(Cc1cc2cc(ncc2[nH]1)S(C)(=O)=O)C(F)(F)F

CNS(=O)(=O)c1ccc(cc1)C(C)(C)c1ccccc1

COC(=O)C(C)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12

COC(=O)C(CC#N)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12

COC(=O)C(CC1CC1)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12

COC(=O)C(Cc1ccccc1)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12

COC(=O)C(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12

COC(=O)C(c1ccc(Cl)cc1Cl)n1ccc2c(NS(C)(=O)=O)cccc12

COC(=O)C(c1ccc(F)cc1)n1ccc2c(NS(C)(=O)=O)cccc12

COC(=O)C(c1ccc(F)cc1Cl)n1ccc2c(Cl)cccc12

COC(=O)C(c1ccc(F)cc1Cl)n1ccc2c(F)cccc12

COC(=O)C(c1ccc(F)cc1Cl)n1ccc2c(NC(=O)C(F)(F)F)cccc12

COC(=O)C(c1ccc(F)cc1Cl)n1ccc2c(NS(=O)(=O)C(F)(F)F)cccc12

COC(=O)C(c1ccc(F)cc1Cl)n1ccc2c(NS(C)(=O)=O)cccc12

COC(=O)C(c1ccc(F)cc1Cl)n1ccc2c(cccc12)C#N

COC(=O)C(c1ccc(F)cc1Cl)n1ccc2ccccc12

COC(=O)C(c1ccc(OC)cc1)n1ccc2c(NS(C)(=O)=O)cccc12

COC(=O)C(c1ccc(cc1)-c1ccccc1Cl)n1ccc2c(NS(C)(=O)=O)cccc12

COC(=O)C(c1ccccc1)n1ccc2c(NS(C)(=O)=O)cccc12

COC(=O)C1=C(C)N=C(C)C(C#N)C1c1ccc(F)cc1Cl |c:4,t:7|

COC(=O)C1=C(C)N=C(C)C(C#N)C1c1ccccc1Cl |c:4,t:7|

COC(=O)C1=C(C)N=C(C)C(C#N)[C@@H]1c1ccnc2ccccc12 |r,c:4,t:7|

COC(=O)C1=C(C)N=C(C)C(C#N)[C@H]1c1ccnc2ccccc12 |r,c:4,t:7|

COC(=O)C1=C(CCl)N=C(C)C(C#N)[C@@H]1c1ccc(F)cc1Cl |r,c:4,t:8|

COC(=O)C1=C(CCl)N=C(C)C(C#N)[C@@H]1c1ccnc2ccccc12 |r,c:4,t:8|

COC(=O)C1=C(CCl)N=C(C)C(C#N)[C@H]1c1ccc(F)cc1Cl |r,c:4,t:8|

COC(=O)C1=C(CCl)N=C(C)C(C#N)[C@H]1c1ccnc2ccccc12 |r,c:4,t:8|

COC(=O)C1=C(Cc2ccccc2)N=C(C)C(C#N)C1c1ccccc1Cl |c:4,t:14|

COC(=O)C1=C(Cn2cccn2)N=C(C)C(C#N)C1c1ccc(F)cc1Cl |c:4,t:13|

COC(=O)C1=C(Cn2ccnc2)N=C(C)C(C#N)C1c1ccc(F)cc1Cl |c:4,t:13|

COC(=O)C1=C(Cn2cncn2)N=C(C)C(C#N)C1c1ccc(F)cc1Cl |c:4,t:13|

COC(=O)C1=C(Cn2cnnn2)N=C(C)C(C#N)C1c1ccc(F)cc1Cl |c:4,t:13|

COC(=O)C1=C(Cn2cnnn2)N=C(C)C(C#N)[C@H]1c1ccc(F)cc1Cl |r,c:4,t:13|

COC(=O)C1=C(N(C)C(C)=C(C#N)C1c1ccc(F)cc1Cl)C(F)(F)F |t:4,9|

COC(=O)C1=C(N=C(C)C(C#N)C1c1ccc(F)cc1Cl)C(F)(F)F |t:4,6|

COC(=O)C1=C(N=C(C)C(C#N)C1c1ccccc1Cl)C(C)C |t:4,6|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccc(C)cc1 |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccc(Cl)c(F)c1 |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccc(Cl)cc1 |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccc(F)cc1 |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccc(F)cc1Cl |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccc(O)cc1 |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccc(OC)cc1 |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccc(cc1)C(F)(F)F |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1cccc(C)c1 |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1cccc(Cl)c1 |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1cccc(F)c1 |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1cccc(O)c1 |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1cccc(OC)c1 |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1cccc(c1)C#N |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1cccc(c1)C(F)(F)F |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccccc1C |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccccc1C(F)(F)F |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccccc1Cl |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccccc1F |c:16,t:13|

COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccccc1OC |c:16,t:13|

COC(=O)C1[C@@H](C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |r,c:16,t:13|

COC(=O)C1[C@H](C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |r,c:16,t:13|

COC(=O)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

COC(=O)[C@@H]1CC2=CC(=O)CC[C@]2(C)C2[C@@H]3O[C@@H]3[C@@]3(C)C(CC[C@@]33CCC(=O)O3)C12 |t:6|

COC(=O)[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@@]23O[C@@H]2C[C@@]2(C)[C@@H](CC[C@@]22CCC(=O)O2)[C@H]13 |r,t:6|

COC(=O)c1c(C)nc(C)c(C(=O)CC2CCC2)c1-c1cccc2c1oc(C)cc2=O |(52.63,-36.51,;51.3,-37.29,;49.96,-36.52,;49.96,-34.98,;48.63,-37.3,;48.64,-38.85,;49.97,-39.62,;47.3,-39.62,;45.96,-38.85,;44.63,-39.62,;45.97,-37.3,;44.63,-36.53,;45.39,-35.2,;43.3,-37.3,;43.3,-38.84,;42.21,-39.93,;43.3,-41.02,;44.38,-39.93,;47.29,-36.53,;47.29,-34.99,;48.62,-34.22,;48.62,-32.69,;47.28,-31.92,;45.94,-32.71,;45.95,-34.24,;44.64,-35.01,;43.31,-34.26,;41.99,-35.05,;43.3,-32.73,;44.62,-31.95,;44.61,-30.41,)|

COCC(C(=O)OC)(c1ccc(Cl)cc1)n1ccc2c(NS(C)(=O)=O)cccc12

COCC1=C(C(C(C#N)C(C)=N1)c1ccccc1Cl)C(=O)OC |c:10,t:3|

COCCN1C(C)=C(C#N)C(C(C(=O)OC(C)(C)C)=C1C)c1ccc(F)cc1F |c:18,t:6|

COCOCc1cc(F)ccc1\C=C1/Oc2ccc(O)c(OC)c2C2=C1C1C(NC(C)(C)C=C1C)C=C2 |w:27.38,26.28,c:26,35,39|

COC[C@@H]1CN([C@@H](CO1)c1ccccc1)c1ccc2OCC(=O)Nc2n1 |r|

COC[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc(CN=O)cc1)OC |r,c:17,t:10|

COCc1cc(ccc1C#N)N1N=C2[C@H](CCc3cc(ccc23)C(O)=O)[C@@H]1C1CCCC1 |r,c:13|

COCc1ccsc1\C=C1/Oc2ccc(O)c(OC)c2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:30|

CO\N=C(/C)c1ccsc1\C=C1/Oc2ccc(O)c(OC)c2-c2ccc3NC(C)(C)C=C(C)c3c12 |t:32|

CO\N=C1/C(O)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(C)c[nH]c12 |(1.85,6.27,;1.84,4.74,;.5,3.98,;.49,2.44,;1.82,1.66,;3.16,2.41,;1.81,.12,;3.13,.9,;3.13,-.65,;.47,-.64,;-.85,.14,;-2.18,-.62,;-3.5,.15,;-4.84,-.61,;-3.5,1.69,;-2.17,2.46,;-2.17,3.99,;-.84,1.68,;-4.82,2.47,;-4.82,4.01,;-6.16,4.79,;-7.49,4.01,;-7.5,2.47,;-8.64,1.44,;-9.98,2.21,;-8.02,.03,;-6.48,.19,;-6.16,1.7,)|

COc1c(O)ccc2OC(=Cc3sccc3C(C)N=O)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |w:10.10,t:30|

COc1c(O)ccc2O\C(=C/c3ccc(F)cc3CO)C3=C(C=CC4NC(C)(C)C=C(C)C34)c12 |w:24.24,32.33,c:23,t:21,30|

COc1c(O)ccc2O\C(=C/c3cccc(C)c3F)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |t:29|

COc1c(O)ccc2O\C(=C/c3cccc(O)c3)C3=C(C=CC4NC(C)(C)C=C(C)C34)c12 |w:22.22,30.31,c:21,t:19,28|

COc1c(O)ccc2O\C(=C/c3sccc3C(C)O)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |t:29|

COc1c(O)ccc2O\C(=C/c3sccc3C(O)C(F)(F)F)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |t:32|

COc1c(O)ccc2O\C(=C/c3sccc3CO)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |t:28|

COc1cc(CNC(=O)C2(Cc3ccccc3)CC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)C2(Cc3ccccc3)CCN(Cc3ccccc3)C2)cc(OC)c1

COc1cc(CNC(=O)C2(Cc3ccccc3)CCN([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)C2(Cc3ccccc3)CN(Cc3ccccc3)C(=O)N2)cc(OC)c1

COc1cc(CNC(=O)C2(Cc3ccccc3)CN(Cc3ccccc3)C(=O)O2)cc(OC)c1

COc1cc(CNC(=O)[C@@]2(Cc3ccc(Cl)cc3)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccc(F)cc3)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccc4ccccc4c3)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccc4nonc4c3)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3cccc(Cl)c3)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3cccc(F)c3)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3cccc4nonc34)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)N(C)C(=O)N(Cc3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)NC(=O)N(Cc3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N(C(C)C)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N(C3CCCc4ccccc34)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N(C3CCN(CC3)C(=O)C(F)(F)F)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N(Cc3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N([C@@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N([C@@H]3CCc4ccccc34)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N([C@H](C)C3CCCCC3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N([C@H](C)c3ccc(Cl)cc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N([C@H](C)c3ccc(F)cc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3Cl)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccc3F)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccccn3)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)[C@@]2(Cc3ccncc3)OC(=O)N(Cc3ccccc3)C2=O)cc(OC)c1 |r|

COc1cc(CNC(=O)c2oc(=O)n(Cc3ccccc3)c2O)cc(OC)c1

COc1cc(C[C@H]2C(=C)CCCC2(C)C)c(O)cc1Br

COc1cc(F)ccc1-c1c(C)[nH]c2c(NS(C)(=O)=O)cc(F)cc12 |(-1,4.66,;-.24,3.69,;1.29,3.91,;1.86,5.34,;3.38,5.55,;3.84,6.7,;4.33,4.34,;3.76,2.91,;2.23,2.7,;1.76,1.24,;2.66,.02,;3.89,.03,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-1.02,-3.09,;-2.35,-3.87,;-3.42,-3.26,;-2.35,-5.1,;-3.42,-4.49,;-2.38,-.77,;-2.38,.77,;-3.45,1.38,;-1.03,1.55,;.3,.77,)|

COc1cc(F)ccc1-c1c(CN(C)Cc2ccccc2)[nH]c2c(N)cc(F)cc12 |(-1,4.66,;-.24,3.69,;1.29,3.91,;1.86,5.34,;3.38,5.55,;3.84,6.7,;4.33,4.34,;3.76,2.91,;2.23,2.7,;1.76,1.24,;2.66,.02,;4.2,.03,;4.98,-1.29,;4.37,-2.37,;6.52,-1.28,;7.3,-2.61,;8.84,-2.59,;9.62,-3.92,;8.87,-5.26,;7.33,-5.27,;6.54,-3.95,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-1.03,-2.79,;-2.38,-.77,;-2.38,.77,;-3.45,1.38,;-1.03,1.55,;.3,.77,)|

COc1cc(F)ccc1-c1c(CN(C)Cc2ccccc2)[nH]c2c(NS(C)(=O)=O)cc(cc12)C(C)(C)C |(-1,4.66,;-.24,3.69,;1.29,3.91,;1.86,5.34,;3.38,5.55,;3.84,6.7,;4.33,4.34,;3.76,2.91,;2.23,2.7,;1.76,1.24,;2.66,.02,;4.2,.03,;4.98,-1.29,;4.37,-2.37,;6.52,-1.28,;7.3,-2.61,;8.84,-2.59,;9.62,-3.92,;8.87,-5.26,;7.33,-5.27,;6.54,-3.95,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-1.02,-3.09,;-2.35,-3.87,;-3.42,-3.26,;-2.35,-5.1,;-3.42,-4.49,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;-3.72,1.53,;-4.78,.91,;-3.72,2.76,;-4.79,2.14,)|

COc1cc(F)ccc1-c1c(CN(C)Cc2ccccc2)[nH]c2c(NS(C)(=O)=O)cc(cc12)C(C)C |(-1,4.66,;-.24,3.69,;1.29,3.91,;1.86,5.34,;3.38,5.55,;3.84,6.7,;4.33,4.34,;3.76,2.91,;2.23,2.7,;1.76,1.24,;2.66,.02,;4.2,.03,;4.98,-1.29,;4.37,-2.37,;6.52,-1.28,;7.3,-2.61,;8.84,-2.59,;9.62,-3.92,;8.87,-5.26,;7.33,-5.27,;6.54,-3.95,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-1.02,-3.09,;-2.35,-3.87,;-3.42,-3.26,;-2.35,-5.1,;-3.42,-4.49,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;-3.72,1.53,;-3.72,2.76,;-4.78,.91,)|

COc1cc(F)ccc1-c1c(Cc2ccccc2)[nH]c2c(NS(C)(=O)=O)cc(cc12)C(C)C |(-1,4.66,;-.24,3.69,;1.29,3.91,;1.86,5.34,;3.38,5.55,;3.84,6.7,;4.33,4.34,;3.76,2.91,;2.23,2.7,;1.76,1.24,;2.66,.02,;4.2,.03,;4.98,-1.29,;6.52,-1.28,;7.3,-2.61,;6.54,-3.95,;5,-3.96,;4.22,-2.63,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-1.02,-3.09,;-2.35,-3.87,;-3.42,-3.26,;-2.35,-5.1,;-3.42,-4.49,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;-3.72,1.53,;-3.72,2.76,;-4.78,.91,)|

COc1cc(NC(=O)c2ccc(c(CCN(C)C3CC3)c2)-c2ccccc2OC(F)(F)F)ccc1S(N)(=O)=O

COc1cc(NC(=O)c2ccc(c(CCN3CC(C)OC(C)C3)c2)-c2ccccc2OC(F)(F)F)ccc1S(N)(=O)=O

COc1cc(NC(=O)c2ccc(c(CO)c2)-c2ccccc2-c2cccs2)ccc1S(N)(=O)=O

COc1cc(NC(=O)c2ccc(c(CO)c2)-c2ccccc2OC(F)(F)F)ccc1S(N)(=O)=O

COc1cc(NC(=O)c2ccc(c(COC(C)=O)c2)-c2ccccc2C(F)(F)F)ccc1S(N)(=O)=O

COc1cc(NS(C)(=O)=O)c2[nH]c(C)c(-c3cc(F)ccc3OC)c2c1 |(-3.72,2.76,;-3.72,1.53,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;-1.02,-3.09,;-2.35,-3.87,;-3.42,-3.26,;-2.35,-5.1,;-3.42,-4.49,;.3,-.77,;1.76,-1.24,;2.66,.02,;3.89,.03,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;5.55,4.52,;3.38,5.55,;1.86,5.34,;1.29,3.91,;-.24,3.69,;-1,4.66,;.3,.77,;-1.03,1.55,)|

COc1cc(NS(C)(=O)=O)c2[nH]c(C)c(-c3ccccc3)c2c1

COc1cc(OC)cc(c1)-c1cnc([nH]1)[C@@]1(Cc2ccccc2)OC(=O)N([C@H](C)c2ccccc2)C1=O |r|

COc1cc(OC)cc(c1)-c1nnc([nH]1)[C@@]1(Cc2ccccc2)OC(=O)N([C@H](C)c2ccccc2)C1=O |r|

COc1cc(OC)cc(c1)-c1nnc(o1)[C@@]1(Cc2ccccc2)OC(=O)N([C@H](C)c2ccccc2)C1=O |r|

COc1cc(OC)nc(n1)-c1nnc(o1)[C@@]1(Cc2ccccc2)OC(=O)N([C@H](C)c2ccccc2)C1=O |r|

COc1cc(ccc1C#N)-c1cn(C(C)C)c2cc(NS(C)(=O)=O)ccc12

COc1cc(ccc1C#N)N1N=C2[C@H](CCc3cc(ccc23)C(O)=O)[C@@H]1C1CCCC1 |r,c:12|

COc1cc(ccc1C(O)=O)C1=NN([C@@H](C2CCCC2)[C@H]1C)c1ccc(C#N)c(Cl)c1 |r,t:12|

COc1cc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:12|

COc1cc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)n1 |r,t:12|

COc1cc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1 |r,t:12|

COc1cc(ccc1C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1)C(O)=O |r,t:9|

COc1cc(ccc1S(N)(=O)=O)C(=O)Nc1ccc(c(CCN(C)C2CC2)c1)-c1ccccc1OC(F)(F)F

COc1cc2CC\C=C/CCC[C@@H](C)OC(=O)c2c(OC)c1 |r,c:7|

COc1ccc(C)c(c1)C(C)(C)CC(O)(Cn1ccc(=O)c2ccccc12)C(F)(F)F

COc1ccc(CC(O)(CC(C)(C)c2cc(F)ccc2OC)C(F)(F)F)cc1 |w:7.7|

COc1ccc(CCc2ccnc(NC(N)=O)c2)cc1

COc1ccc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N([C@H](C)c3ccccc3)C2=O)cc1 |r|

COc1ccc(Cl)cc1-c1c[nH]c2c(NS(C)(=O)=O)cccc12

COc1ccc(Cn2cnc(c2-c2ccnc(NC(N)=O)c2)-c2ccc(F)cc2)c(OC)c1

COc1ccc(F)cc1-c1c([nH]c2c(NS(C)(=O)=O)cccc12)-c1ccccc1 |(-1,4.66,;-.24,3.69,;1.29,3.91,;1.86,5.34,;3.38,5.55,;4.33,4.34,;5.55,4.52,;3.76,2.91,;2.23,2.7,;1.76,1.24,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-1.02,-3.09,;-2.35,-3.87,;-3.42,-3.26,;-2.35,-5.1,;-3.42,-4.49,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;4.2,.03,;5.05,1.3,;6.59,1.2,;7.27,-.19,;6.41,-1.46,;4.87,-1.36,)|

COc1ccc(F)cc1-c1c[nH]c2c(NC(C)=O)cccc12

COc1ccc(F)cc1-c1ccc2NC(C)(C)C=C(CSCC=C)c2c1 |t:18|

COc1ccc(F)cc1-c1ccc2NC(C)(C)C=C(CSCCc3ccccc3)c2c1 |t:18|

COc1ccc(F)cc1C(C)(C)CC(C)(O)Cc1cc2ccncc2[nH]1

COc1ccc(F)cc1C(C)(C)CC(O)(C(=O)Nc1ccc2c(c1)c(C)noc2=O)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(CCCc1ccccc1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(CCc1ccccc1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(CN1CCC(=O)CC1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(CN1CCC(=O)c2ccccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(CN1CCCc2ccccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(CN1CCOCC1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(CN1CCOc2ccccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(CN1C[C@H](C)C(=O)[C@H](C)C1)C(F)(F)F |r|

COc1ccc(F)cc1C(C)(C)CC(O)(CN1C[C@H](C)O[C@@H](C)C1)C(F)(F)F |r|

COc1ccc(F)cc1C(C)(C)CC(O)(CN1C[C@H](C)O[C@H](C)C1)C(F)(F)F |r|

COc1ccc(F)cc1C(C)(C)CC(O)(CNc1ccc2C(=O)OCc2c1)Cc1ccccc1

COc1ccc(F)cc1C(C)(C)CC(O)(CNc1ccc2c(c1)c(C)noc2=O)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(CNc1cccc2ccccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(CNc1cccc2nc(C)ccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(CNc1cccc2ncccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1c(C)ccc2ccccc12)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1c(Cl)cccc1Cl)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc(C)c(C#N)c(C)c1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc(C)cc(C)c1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc(C)cc(C)c1C#N)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc(C)cc(Cl)c1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc(Cl)cc(Cl)c1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc(Cl)cc(c1)C#N)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc(Cl)ccc1Cl)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2c(C)cccc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2c(cccc2[nH]1)C#N)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2c(cccc2[nH]1)C(F)(F)F)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cc(C)ccc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cc(F)ccc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cc(ccc2[nH]1)C#N)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cc(ccc2[nH]1)C(F)(F)F)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cc(ncc2[nH]1)N1CCOCC1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cc[n+]([O-])cc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccc(C)cc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccc(F)cc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccc(cc2[nH]1)C#N)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccc(cc2[nH]1)C(F)(F)F)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cccc(C#N)c2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cccc(C)c2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cccc(F)c2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cccc(c2[nH]1)C(F)(F)F)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccccc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccccn2n1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cccnc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccncc2[nH]1)C(C)(C)C

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccncc2[nH]1)C(C)C

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccncc2[nH]1)C1CC1

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccncc2[nH]1)C1CCC1

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccncc2[nH]1)C1CCCC1

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccncc2o1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccncc2s1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cnccc2[nH]1)C(C)(C)C

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cnccc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cnccc2[nH]1)C1CC1

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cncnc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ncccc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ncncc2[nH]1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(C#N)c2ccccc12)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(C)c2ccccc12)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(C)cc1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(C=O)cc1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(C=O)cc1Cl)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(Cl)cc1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(Cl)cc1Cl)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(cc1)C#N)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(cc1Cl)C#N)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc(cc1F)C#N)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccc2ccccc2c1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cccc(C)c1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cccc(Cl)c1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cccc(Cl)c1Cl)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cccc(c1)C#N)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1cccc2ccccc12)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccccc1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccccc1Br)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccccc1C)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccccc1Cl)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cc1ccccc1F)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1cc(C)c(=O)c(C)c1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1cc(C)nc1C)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1ccc(=O)c2ccccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1ccc(=O)c2cnccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1ccc(=O)c2ncccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1ccc(=O)cc1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1ccc2ccncc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1ccc2ncccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1ccnc1)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1cnc(=O)c2ccccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(Cn1cnc2ccccc12)C(F)(F)F

COc1ccc(F)cc1C(C)(C)CC(O)(c1ccccc1)C(F)(F)F |w:13.14|

COc1ccc(F)cc1C(C)(C)C[C@@](O)(Cc1cc2cc(ccc2[nH]1)C#N)C(F)(F)F |r|

COc1ccc(F)cc1C(C)(C)C[C@@](O)(Cc1cc2ccccc2[nH]1)C(F)(F)F |r|

COc1ccc(F)cc1C(C)(C)C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F |r|

COc1ccc(F)cc1C(C)(C)C[C@@](O)(Cc1cc2cnccc2[nH]1)C(F)(F)F |r|

COc1ccc(F)cc1C(C)(C)C[C@](O)(Cc1cc2ccccc2[nH]1)C(F)(F)F |r|

COc1ccc(F)cc1C(C)(C)C[C@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F |r|

COc1ccc(cc1)-n1nccc1-c1ccnc(NC(N)=O)c1

COc1ccc(cc1)C(c1c[nH]c2ccccc12)c1ccccc1

COc1ccc(cc1)N1N=C(CC1c1ccc(F)cc1)c1ccc(cc1)C(O)=O |c:10|

COc1ccc(cc1-c1ccc(CNS(=O)(=O)c2c(C)noc2C)cc1)C#N

COc1ccc(cc1C(C)(C)CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)-c1ccccc1

COc1ccc(cc1C(C)(C)CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)-c1ccncc1

COc1ccc(cc1C(C)(C)C[C@@](O)(Cc1cc2ccncc2[nH]1)C(F)(F)F)-c1cncnc1 |r|

COc1ccc(cn1)[C@@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)[C@H](C)NC(=O)C1CC1 |r|

COc1ccc2cc[nH]c2c1-c1cc(C)c2NC(C)(C)CC(C)c2c1Cl |w:21.23,(12.35,-42.62,;12.35,-44.16,;11.02,-44.93,;9.69,-44.17,;8.36,-44.94,;8.37,-46.49,;7.24,-47.52,;7.87,-48.91,;9.39,-48.74,;9.7,-47.25,;11.03,-46.48,;12.36,-47.25,;12.36,-48.8,;13.69,-49.57,;13.69,-51.11,;15.02,-48.8,;16.36,-49.58,;17.71,-48.8,;18.1,-50.28,;19.19,-48.4,;17.71,-47.25,;16.37,-46.46,;16.37,-44.92,;15.03,-47.24,;13.68,-46.48,;13.68,-44.94,)|

COc1cccc(CCc2ccnc(NC(N)=O)c2)c1

COc1cccc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N(Cc3ccccc3)C2=O)c1 |r|

COc1cccc(CNC(=O)[C@@]2(Cc3ccccc3)OC(=O)N([C@H](C)c3ccccc3)C2=O)c1 |r|

COc1cccc(c1)-c1ccccc1CNC(=O)c1cnc2n(C)nc(C)c2c1Cl

COc1cccc(c1)-n1nccc1-c1ccnc(NC(N)=O)c1

COc1cccc(c1)C1CC(=NN1c1ccc(cc1)C#N)c1ccc(cc1)C(O)=O |c:11|

COc1cccc(c1)C1CCN(CC1)c1[nH]c(=O)[nH]c(=O)c1Cc1ccccc1

COc1cccc(c1)[C@@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)[C@H](C)NC(=O)C(F)(F)F |r|

COc1cccc2OC(c3cc(C)cc(C)c3)c3cc(NS(C)(=O)=O)ccc3-c12

COc1cccc2OC(c3cc(Cl)cc(Cl)c3)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |t:27|

COc1cccc2OC(c3ccc(C)cc3)c3cc(NS(C)(=O)=O)ccc3-c12

COc1cccc2OC(c3ccc(F)cc3)c3cc(NS(C)(=O)=O)ccc3-c12

COc1cccc2OC(c3cccc(C)c3)c3cc(NS(C)(=O)=O)ccc3-c12

COc1cccc2OC(c3cccc(Cl)c3)c3cc(NS(C)(=O)=O)ccc3-c12

COc1cccc2OC(c3cccc(F)c3)c3cc(NS(C)(=O)=O)ccc3-c12

COc1cccc2OC(c3cccc(OC(=O)N(C)C)c3)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |t:31|

COc1cccc2OC(c3cccc(OCSC)c3)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |t:29|

COc1cccc2OC(c3cccc(c3)C(F)(F)F)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |t:29|

COc1cccc2OC(c3ccccc3)c3c(Br)c(NS(C)(=O)=O)ccc3-c12

COc1cccc2OC(c3ccccc3)c3c(ccc4NC(C)(C)C=C(C)c34)-c12 |t:25|

COc1cccc2OC(c3ccccc3)c3cc(NS(C)(=O)=O)ccc3-c12

COc1cccc2OC(c3cccs3)c3cc(NS(C)(=O)=O)ccc3-c12

COc1ccccc1-c1c[nH]c2c(NS(C)(=O)=O)cccc12

COc1ccccc1-c1ccc2NC(C)(C)C=C(C(C)OCC=C)c2c1 |t:17|

COc1ccccc1-n1nccc1-c1ccnc(NC(N)=O)c1

COc1ccccc1C1CCN(CC1)c1[nH]c(=O)[nH]c(=O)c1Cc1ccccc1

COc1ccccc1CCc1cccc(NC(N)=O)n1

COc1ccccc1CCc1ccnc(NC(N)=O)c1

COc1ccccc1CNC(=O)[C@@]1(Cc2ccccc2)OC(=O)N([C@H](C)c2ccccc2)C1=O |r|

COc1nc(ccc1C(=O)N(C)C)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:14|

COc1nc(ccc1C(=O)N(C)C)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)n1 |r,t:14|

COc1nc(ccc1C(=O)NS(C)(=O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:16|

COc1nc(ccc1C(=O)NS(C)(=O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)n1 |r,t:16|

COc1nc(ccc1C(=O)Nc1nnn[nH]1)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:18|

COc1nc(ccc1C(N)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:12|

COc1nc(ccc1C(N)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)n1 |r,t:12|

COc1nc(ccc1C(O)=O)C1=NN([C@@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:12|

COc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C(C)C)c1ccc(C#N)c(C)n1 |r,t:12|

COc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)c1 |r,t:12|

COc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(C)n1 |r,t:12|

COc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1 |r,t:12|

COc1ncc(cc1-c1ccc(cc1)[C@@H](C)NS(=O)(=O)c1cn(C)nc1C(F)(F)F)C#N |r|

CS(=O)(=O)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

CS(=O)(=O)Nc1ccc(Nc2ccccc2)cc1

CS(=O)(=O)Nc1ccc(cc1)N(C(=O)c1ccccc1)c1ccc(F)cc1

CS(=O)(=O)Nc1ccc(cc1)N(C(=O)c1ccccc1)c1ccccc1

CS(=O)(=O)Nc1ccc(cc1)N(Cc1ccccc1)c1ccccc1

CS(=O)(=O)Nc1ccc-2c(c1)C(Oc1cccc(OC(F)F)c-21)c1ccccc1

CS(=O)(=O)Nc1ccc2N(C(=O)C(Oc2c1)c1ccccc1)c1ccc(F)cc1

CS(=O)(=O)Nc1ccc2N(C(=O)C3(CC3)Oc2c1)c1ccc(F)cc1

CS(=O)(=O)Nc1ccc2N(C(=O)C3(CCC3)Oc2c1)c1ccc(F)cc1

CS(=O)(=O)Nc1ccc2N(C(=O)COc2c1)c1ccc(F)cc1

CS(=O)(=O)Nc1cccc2c(c[nH]c12)-c1ccc(F)cc1

CS(=O)(=O)Nc1cccc2c(c[nH]c12)-c1cccc(Cl)c1

CS(=O)(=O)Nc1cccc2cc[nH]c12

CSc1ccc(cc1)[C@@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)[C@H](C)NS(=O)(=O)C1CC1 |r|

C[C@@H](CNc1cccc2n(ncc12)-c1ccc(F)cc1)NS(=O)(=O)c1c(C)cc(C)cc1C |r|

C[C@@H](CNc1cccc2n(ncc12)-c1ccc(F)nc1)NS(=O)(=O)c1c(C)nn(C2CCCC2)c1C |r|

C[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1c(C)cc(C)cc1C

C[C@@H](N1C(=O)N[C@](Cc2ccccc2)(C(=O)N2CCc3ccccc3C2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc(co1)-c1ccccc1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2c(Cl)cccc2[nH]1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2c(F)cccc2[nH]1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2c(NC(C)=O)cccc2[nH]1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2c(NS(C)(=O)=O)cccc2[nH]1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2c(cccc2[nH]1)-c1cc[nH]n1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2c(cccc2[nH]1)-c1cccnc1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2c(cccc2[nH]1)-c1ccncc1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2c(cccc2[nH]1)-c1cncnc1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2c(cccc2[nH]1)-c1cnn(C)c1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2c(cccc2[nH]1)-c1cnoc1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2c(cccc2[nH]1)C(F)(F)F)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(Cl)ccc2[nH]1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(F)ccc2[nH]1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(NC(C)=O)ccc2[nH]1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(NS(C)(=O)=O)ccc2[nH]1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(OC(F)(F)F)ccc2[nH]1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)-c1cc[nH]n1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)-c1ccccn1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)-c1cccnc1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)-c1cccnc1Cl)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)-c1ccncc1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)-c1cn[nH]c1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)-c1cncnc1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)-c1cnn(C)c1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)-c1cnoc1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)-c1conc1C)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)-n1cnnn1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)C#N)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)C(F)(F)F)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2cc(ccc2[nH]1)N1CCOCC1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nc2ccccc2[nH]1)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1ncc(Cc2ccccc2)[nH]1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1ncc(Cc2ccccc2)o1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1ncc([nH]1)-c1ccccc1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1ncc(o1)-c1ccccc1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc(CC2CC2)o1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc(Cc2ccccc2)[nH]1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc(Cc2ccccc2)o1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc([nH]1)-c1ccc(Cl)c(Cl)c1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc([nH]1)-c1ccccc1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc(o1)-c1cc(F)cc(F)c1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc(o1)-c1ccc(Cl)c(Cl)c1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc(o1)-c1ccccc1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc(o1)-c1ccncc1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@@](Cc2ccccc2)(C1=O)c1nnc(o1)C1(CC1)c1ccccc1)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccc(F)cc2)(C(=O)NCc2ccc(Cl)c(Cl)c2)C1=O)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)N2CCc3ccccc3C2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NC2CC2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NC2CCC2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NC2CCCCC2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCCc2ccccn2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCCc2ccncc2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCCc2cn[nH]c2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCCc2nnc[nH]2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2cc(C)no2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2ccc(Cl)cc2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2ccc(cc2)C(F)(F)F)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2ccc(cc2)S(C)(=O)=O)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2ccc3ccccc3n2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2ccc3cnccc3c2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2cccc(Cl)c2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2cccc(c2)C(F)(F)F)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2cccc(c2)S(C)(=O)=O)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2cccc3ccnn23)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2cccc3cnccc23)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2ccccn2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2cccnc2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)NCc2ccncc2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)N[C@H]2C[C@@H](C2)c2ccccc2)C1=O)c1ccccc1 |r,wU:6.14,1.0,19.22,wD:6.6,17.17,(48.57,-12.23,;49.2,-10.83,;48.3,-9.58,;48.79,-8.11,;50.26,-7.64,;47.54,-7.2,;46.3,-8.12,;45.52,-6.77,;46.28,-5.44,;47.83,-5.44,;48.6,-4.1,;47.82,-2.77,;46.27,-2.78,;45.52,-4.12,;44.76,-8.17,;43.95,-6.86,;44.04,-9.53,;42.5,-9.58,;41.38,-8.53,;40.33,-9.66,;41.46,-10.71,;38.8,-9.71,;37.98,-8.4,;36.44,-8.45,;35.72,-9.81,;36.54,-11.12,;38.08,-11.06,;46.79,-9.58,;45.89,-10.83,;50.74,-10.85,;51.49,-12.2,;53.03,-12.22,;53.82,-10.89,;53.06,-9.55,;51.52,-9.53,)|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)N[C@H]2C[C@H](C2)c2ccccc2)C1=O)c1ccccc1 |r,wU:6.14,1.0,17.17,19.22,wD:6.6,(53.09,-16.89,;53.72,-15.48,;52.82,-14.23,;53.31,-12.76,;54.78,-12.29,;52.06,-11.85,;50.82,-12.77,;50.04,-11.43,;50.8,-10.09,;52.35,-10.09,;53.11,-8.76,;52.34,-7.42,;50.79,-7.44,;50.03,-8.77,;49.28,-12.82,;48.46,-11.52,;48.55,-14.18,;47.01,-14.23,;45.97,-15.36,;44.85,-14.31,;45.9,-13.19,;43.31,-14.36,;42.5,-13.05,;40.96,-13.11,;40.23,-14.47,;41.06,-15.78,;42.59,-15.72,;51.3,-14.24,;50.4,-15.49,;55.26,-15.5,;56.01,-16.85,;57.55,-16.87,;58.34,-15.55,;57.57,-14.2,;56.04,-14.19,)|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)Nc2ccc(Cl)cc2)C1=O)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)Nc2ccc(F)cc2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)Nc2ccc(cc2)C#N)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)Nc2ccc3ccccc3c2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)Nc2cccc(Cl)c2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)Nc2cccc(F)c2)C1=O)c1ccccc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)Nc2ccccc2)C1=O)c1ccc(F)cc1 |r|

C[C@@H](N1C(=O)O[C@](Cc2ccccc2)(C(=O)Nc2ccccc2Cl)C1=O)c1ccccc1 |r|

C[C@@H](NC(=O)[C@@]1(Cc2ccccc2)OC(=O)N([C@H](C)c2ccccc2)C1=O)c1cccc(Cl)c1 |r|

C[C@@H](O)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4(C)[C@H]3CCC12C(=O)[CH-][N+]#N |r,t:10|

C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@H]2CC[C@@]3(C)[C@@H](CC[C@]33OCC=C3)[C@H]12 |r,c:23,t:3|

C[C@@H]1CCCCCCCc2cc(O)cc(O)c2C(=O)O1 |r|

C[C@@H]1CCCCCCCc2cc(OC(C)=O)cc(OC(C)=O)c2C(=O)O1 |r|

C[C@@H]1CCCCCCCc2cc(OS(=O)(=O)c3ccc(C)cc3)cc(OS(=O)(=O)c3ccc(C)cc3)c2C(=O)O1 |r|

C[C@@H]1CCc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

C[C@@H]1CN(CCN1c1nccc(n1)C(=O)NC1C2CC3CC1CC(O)(C3)C2)c1ccc(cc1F)S(C)(=O)=O |r,wD:1.0,TLB:15:16:25.19.20:22,16:17:25:20.21.22,THB:18:19:22:26.17.16,18:17:25.19.20:22,16:21:25:26.18.17,(37.25,-23.6,;37.25,-22.06,;35.92,-21.28,;35.92,-19.74,;37.26,-18.98,;38.59,-19.75,;38.58,-21.29,;39.91,-22.07,;39.91,-23.61,;41.25,-24.38,;42.58,-23.61,;42.58,-22.06,;41.24,-21.3,;43.91,-21.28,;43.9,-19.74,;45.25,-22.05,;46.58,-21.27,;46.55,-19.75,;47.53,-18.44,;48.95,-18.98,;48.99,-20.56,;47.99,-21.82,;49.32,-21.31,;49.28,-19.82,;50.75,-20.21,;50.44,-18.52,;47.94,-19.37,;34.6,-18.97,;34.6,-17.43,;33.27,-16.65,;31.94,-17.42,;31.94,-18.97,;33.27,-19.73,;33.26,-21.27,;30.6,-16.64,;29.27,-17.41,;29.82,-15.3,;31.37,-15.3,)|

C[C@@H]1CN(CCO1)c1ccc2OCC(=O)Nc2n1 |r|

C[C@@H]1CN([C@@H](CO1)c1ccc(F)cc1)c1ccc2OCC(=O)Nc2n1 |r|

C[C@@H]1CN([C@@H](CO1)c1cccc(F)c1)c1ccc2OCC(=O)Nc2c1 |r|

C[C@@H]1CN([C@@H](CO1)c1cccc(F)c1)c1ccc2OCC(=O)Nc2n1 |r|

C[C@@H]1CN([C@@H](CO1)c1ccccc1)c1cc2NC(=O)COc2cn1 |r|

C[C@@H]1CN([C@@H](CO1)c1ccccc1)c1ccc2OCC(=O)Nc2c1 |r|

C[C@@H]1CN([C@@H](CO1)c1ccccc1)c1ccc2OCC(=O)Nc2n1 |r|

C[C@@H]1CN([C@@H](CO1)c1ccccc1)c1cnc2OCC(=O)Nc2c1 |r|

C[C@@H]1CN([C@@H](CO1)c1ccccc1)c1ncc2OCC(=O)Nc2n1 |r|

C[C@@H]1CN([C@@H](CO1)c1ccccc1F)c1cc2NC(=O)COc2cn1 |r|

C[C@@H]1CN([C@@H](CO1)c1ccccc1F)c1ccc2OCC(=O)Nc2c1 |r|

C[C@@H]1CN([C@@H](CO1)c1ccccc1F)c1ccc2OCC(=O)Nc2n1 |r|

C[C@@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

C[C@@H]1C[C@@](O)([C@@H](Nc2cccc3nc(C)ccc23)c2ccc(F)c(O)c12)C(F)(F)F |r|

C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(OC(=O)c1ccco1)C(=O)SCF |r,c:12,t:8|

C[C@@H]1Cc2cc3c(cc(=O)[nH]c3cc2N1)C(F)(F)F

C[C@@H]1[C@@H](O)C(C)(C)Nc2c(C)cc(c(Cl)c12)-c1cccc2cc[nH]c12 |r|

C[C@@H]1[C@@H](O)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2cc[nH]c12 |r,wU:2.2,wD:1.0,(14.53,-20.63,;14.54,-22.18,;15.87,-22.97,;17.22,-22.22,;15.85,-24.51,;15.83,-26.05,;17.38,-24.51,;14.5,-25.26,;13.19,-24.48,;11.84,-25.24,;10.52,-24.45,;9.17,-25.2,;10.55,-22.91,;11.88,-22.15,;11.9,-20.61,;13.21,-22.94,;9.22,-22.12,;7.88,-22.87,;6.56,-22.08,;6.58,-20.54,;7.92,-19.79,;8.26,-18.29,;9.79,-18.15,;10.4,-19.56,;9.24,-20.58,)|

C[C@@H]1[C@@H](OC(=O)NC2CCCCC2)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(Cl)c[nH]c12 |r,wU:2.2,wD:1.0,(9.67,-11.46,;9.67,-13,;11.01,-13.78,;12.35,-13.01,;13.68,-13.79,;13.68,-15.33,;15.01,-13.02,;16.35,-13.79,;16.33,-15.33,;17.66,-16.1,;19,-15.34,;19,-13.8,;17.67,-13.02,;11.01,-15.33,;11.77,-16.66,;12.55,-15.33,;9.67,-16.09,;8.34,-15.32,;7.01,-16.1,;5.67,-15.33,;4.34,-16.1,;5.68,-13.78,;7,-13.01,;7,-11.47,;8.34,-13.78,;4.34,-13.01,;4.35,-11.47,;3.02,-10.7,;1.68,-11.47,;1.69,-13.03,;.56,-14.06,;-.95,-13.76,;1.19,-15.46,;2.71,-15.28,;3.02,-13.78,)|

C[C@@H]1[C@@H](OC(=O)NCc2ccccc2)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(Cl)c[nH]c12 |r,wU:2.2,wD:1.0,(22.89,-7.03,;22.89,-8.57,;24.23,-9.35,;25.56,-8.58,;26.89,-9.35,;26.89,-10.89,;28.23,-8.59,;29.56,-9.36,;30.9,-8.59,;32.22,-9.37,;33.56,-8.61,;33.56,-7.06,;32.22,-6.29,;30.89,-7.06,;24.22,-10.89,;25.76,-10.89,;24.21,-12.43,;22.88,-11.66,;21.55,-10.89,;20.22,-11.66,;18.89,-10.89,;17.55,-11.66,;18.89,-9.35,;20.22,-8.58,;20.21,-7.04,;21.55,-9.34,;17.56,-8.58,;17.56,-7.04,;16.23,-6.27,;14.89,-7.04,;14.9,-8.6,;13.77,-9.63,;12.26,-9.32,;14.41,-11.02,;15.93,-10.85,;16.23,-9.35,)|

C[C@@H]1[C@@H](OC(=O)Nc2ccc(cc2)C(C)=O)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2cc[nH]c12 |r,wU:2.2,wD:1.0,(-.28,-33.91,;-.28,-35.45,;1.06,-36.23,;2.39,-35.46,;3.72,-36.23,;3.72,-37.77,;5.06,-35.47,;6.39,-36.24,;6.38,-37.78,;7.71,-38.55,;9.05,-37.78,;9.05,-36.24,;7.72,-35.47,;10.38,-38.56,;11.72,-37.79,;10.38,-40.1,;1.05,-37.77,;2.59,-37.77,;1.04,-39.31,;-.29,-38.54,;-1.62,-37.77,;-2.95,-38.54,;-4.28,-37.77,;-5.62,-38.54,;-4.28,-36.23,;-2.95,-35.46,;-2.96,-33.92,;-1.62,-36.22,;-5.61,-35.46,;-5.61,-33.92,;-6.94,-33.15,;-8.28,-33.92,;-8.27,-35.48,;-9.4,-36.51,;-8.76,-37.9,;-7.24,-37.73,;-6.94,-36.23,)|

C[C@@H]1[C@@H](OC(=O)Nc2cccc(c2)C#N)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2cc[nH]c12 |r,wU:2.2,wD:1.0,(22.68,-34.96,;22.68,-36.5,;24.02,-37.28,;25.36,-36.51,;26.69,-37.28,;26.69,-38.82,;28.03,-36.52,;29.36,-37.29,;29.35,-38.83,;30.68,-39.6,;32.02,-38.83,;32.02,-37.29,;30.69,-36.52,;33.35,-36.52,;34.68,-35.74,;24.02,-38.82,;25.56,-38.82,;24.01,-40.36,;22.68,-39.59,;21.35,-38.82,;20.02,-39.59,;18.69,-38.82,;17.35,-39.59,;18.69,-37.28,;20.02,-36.51,;20.01,-34.97,;21.35,-37.27,;17.35,-36.51,;17.36,-34.97,;16.03,-34.2,;14.69,-34.97,;14.7,-36.53,;13.57,-37.56,;14.21,-38.95,;15.73,-38.78,;16.03,-37.28,)|

C[C@@H]1[C@@H](OC(=O)Nc2cccc(c2)C(C)=O)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2cc[nH]c12 |r,wU:2.2,wD:1.0,(.23,-44.76,;.23,-46.3,;1.57,-47.08,;2.9,-46.31,;4.24,-47.08,;4.23,-48.62,;5.57,-46.32,;6.9,-47.09,;6.9,-48.63,;8.23,-49.4,;9.57,-48.63,;9.56,-47.09,;8.23,-46.32,;10.9,-46.32,;12.23,-47.08,;10.9,-44.78,;1.57,-48.62,;3.1,-48.62,;1.56,-50.16,;.23,-49.39,;-1.11,-48.62,;-2.43,-49.39,;-3.77,-48.62,;-5.1,-49.39,;-3.77,-47.08,;-2.44,-46.31,;-2.44,-44.77,;-1.1,-47.07,;-5.1,-46.31,;-5.09,-44.77,;-6.43,-44,;-7.76,-44.77,;-7.76,-46.33,;-8.88,-47.36,;-8.25,-48.75,;-6.73,-48.58,;-6.42,-47.08,)|

C[C@@H]1[C@H](O)C(C)(C)Nc2c(C)cc(c(Cl)c12)-c1cccc2cc[nH]c12 |r|

C[C@@](C1CC1)(c1c[nH]c2c(NS(C)(=O)=O)cccc12)c1ccc(F)cc1

C[C@@](C1CC1)(c1c[nH]c2c(NS(C)(=O)=O)cccc12)c1ccc(F)cc1F

C[C@@]12[C@H](Cc3c1[nH]c1ccccc31)CC[C@@]1(O)C(C)(C)C(=O)CC[C@]21C |r|

C[C@@]12[C@H](Cc3c1[nH]c1ccccc31)CC[C@@]1(O)C(C)(C)[C@H](O)CC[C@]21C |r|

C[C@H](CCC(=O)NCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:63,70|

C[C@H](CCC(=O)NCCS(O)(=O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:65,72|

C[C@H](CCC(=O)N[C@@H](CCC(=O)N(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12)C(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C |t:36,43|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@@H](C[C@@H]4CC(O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OC(=O)NCC(=O)N(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:63,70|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@@H](C[C@@H]4CC(O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OC(=O)NCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:62,69|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)N(C)C(=O)CCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:63,70|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)N(C)C(=O)NCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:63,70|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)N(C)S(=O)(=O)CCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:64,71|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OC(=O)NCC(=O)N(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:63,70|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OC(=O)NCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:62,69|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OCCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:60,67|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:59,66|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@@H](CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OCCOCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:62,69|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OCCOCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:62,69|

C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4[C@@H](CCCN(C)c5ccc(cc5)[C@H]5C[C@@]6(C)[C@@H](CC[C@@]6(O)C#C)[C@@H]6CCC7=CC(=O)CCC7=C56)[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C |t:44,51|

C[C@H](CN1CCOCC1)n1c2ccc(\C=C3/c4ccc(F)cc4COc4cc(F)ccc34)cc2[nH]c1=NC#N |r|

C[C@H](CN1CCOCC1)n1c2ccc(\C=C3/c4ccccc4COc4cc(F)ccc34)cc2[nH]c1=NC#N |r|

C[C@H](CN1CCOCC1)n1c2ccc(\C=C3/c4ccccc4COc4cc(F)ccc34)cc2[nH]c1=NC(N)=O |r|

C[C@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1c(C)cc(C)cc1C

C[C@H](N1CC[C@@](CCO)(OC1=O)c1ccc(F)cc1)c1ccc(cc1)-c1ccc(F)cc1F |r|

C[C@H](NC(=O)C(C)(F)F)[C@H](Oc1ccc2n(ncc2c1)-c1cccc(c1)C(=O)NCc1cccnc1)c1ccc2COCOc2c1 |r|

C[C@H](NC(=O)C(C)(F)F)[C@H](Oc1ccc2n(ncc2c1)-c1cccc(c1)C(=O)NCc1cccnc1)c1ccc2OCCOc2c1 |r|

C[C@H](NC(=O)C(C)(F)F)[C@H](Oc1ccc2n(ncc2c1)-c1cccc(c1)C(=O)N[C@@H]1CCOC1)c1ccc2OCCOc2c1 |r|

C[C@H](NC(=O)C(C)(F)F)[C@H](Oc1ccc2n(ncc2c1)-c1cccc(c1)C(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc2OCCOc2c1 |r|

C[C@H](NC(=O)C(F)(F)F)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccc2ccccc2c1 |r|

C[C@H](NC(=O)C(F)(F)F)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccccc1 |r|

C[C@H](NC(=O)CO)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |r|

C[C@H](NC(=O)[C@@]1(Cc2ccccc2)OC(=O)N([C@H](C)c2ccccc2)C1=O)c1cccc(Cl)c1 |r|

C[C@H](NS(=O)(=O)C1CC1)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |r|

C[C@H](NS(=O)(=O)C1CC1)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccccc1 |r|

C[C@H](O)Cc1cc(C(=O)Nc2ccc(cc2)S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1-c1ccc(F)cc1 |r,wU:1.0,(29.96,-24.22,;31.49,-24.07,;32.39,-25.31,;32.12,-22.66,;31.21,-21.41,;29.67,-21.41,;29.2,-19.95,;27.74,-19.47,;27.42,-17.97,;26.59,-20.5,;25.13,-20.03,;24.82,-18.52,;23.35,-18.04,;22.21,-19.08,;22.53,-20.59,;24,-21.06,;20.74,-18.6,;19.6,-19.64,;19.96,-17.26,;21.51,-17.25,;30.44,-19.04,;30.44,-17.5,;31.69,-19.95,;33.16,-19.47,;34.29,-20.51,;35.76,-20.03,;36.08,-18.53,;37.55,-18.05,;34.93,-17.49,;33.47,-17.97,;32.32,-16.95,;32.64,-15.44,;31.5,-14.42,;30.03,-14.9,;28.88,-13.87,;29.72,-16.42,;30.87,-17.43,)|

C[C@H](O)Cc1cc(C(=O)Nc2ccc(cc2)S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1C(F)(F)F |r,wU:1.0,(10.44,-22.82,;11.97,-22.66,;12.88,-23.9,;12.6,-21.25,;11.7,-20,;10.16,-20,;9.69,-18.54,;8.22,-18.07,;7.9,-16.56,;7.08,-19.1,;5.61,-18.62,;5.3,-17.11,;3.84,-16.64,;2.69,-17.67,;3.02,-19.18,;4.48,-19.65,;1.22,-17.19,;.08,-18.23,;.44,-15.85,;1.99,-15.85,;10.93,-17.63,;10.93,-16.09,;12.18,-18.54,;13.64,-18.07,;14.78,-19.1,;16.24,-18.63,;16.57,-17.12,;18.03,-16.64,;15.41,-16.09,;13.95,-16.56,;12.81,-15.54,;13.12,-14.03,;11.34,-16.02,;11.71,-14.44,)|

C[C@H](O)[C@@H](C)c1cc(C(=O)Nc2ccc(cc2)S(C)(=O)=O)c(C)n1-c1ccc(F)cc1C(F)(F)F |r,wU:1.0,wD:3.3,(68.05,-24.81,;69.58,-24.65,;70.49,-25.9,;70.21,-23.24,;71.74,-23.08,;69.31,-22,;67.77,-22,;67.3,-20.53,;65.83,-20.06,;65.51,-18.55,;64.69,-21.09,;63.22,-20.61,;62.91,-19.1,;61.45,-18.63,;60.3,-19.66,;60.63,-21.17,;62.09,-21.64,;58.83,-19.18,;57.69,-20.22,;58.05,-17.84,;59.6,-17.84,;68.54,-19.62,;68.54,-18.08,;69.79,-20.53,;71.25,-20.06,;72.39,-21.09,;73.85,-20.62,;74.18,-19.11,;75.64,-18.63,;73.02,-18.08,;71.56,-18.56,;70.42,-17.53,;70.73,-16.02,;68.95,-18.01,;69.32,-16.43,)|

C[C@H](O)[C@@H](C)n1cc(C(=O)Nc2ccc(cc2)S(C)(=O)=O)c(C)c1-c1ccc(F)cc1C(F)(F)F |r,wU:1.0,wD:3.3,(67.48,-25.05,;69.02,-24.89,;69.92,-26.14,;69.64,-23.48,;71.18,-23.32,;68.74,-22.24,;67.2,-22.24,;66.73,-20.77,;65.26,-20.3,;64.94,-18.79,;64.12,-21.33,;62.66,-20.85,;62.34,-19.34,;60.88,-18.87,;59.74,-19.9,;60.06,-21.41,;61.53,-21.88,;58.26,-19.42,;57.13,-20.46,;57.49,-18.08,;59.03,-18.08,;67.97,-19.86,;67.97,-18.32,;69.22,-20.77,;70.69,-20.3,;71.82,-21.33,;73.29,-20.86,;73.61,-19.35,;75.07,-18.88,;72.46,-18.32,;71,-18.8,;69.85,-17.77,;70.16,-16.26,;68.39,-18.25,;68.75,-16.67,)|

C[C@H]1CC2[C@@H]3CC[C@](CC(C)=O)(C(C)=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12 |t:28|

C[C@H]1CC[C@H]2Nc3cc4n(C)c(=O)cc(c4cc3[C@H]2C1)C(F)(F)F

C[C@H]1CCc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

C[C@H]1CN([C@@H](CO1)c1ccccc1)c1ccc2OCC(=O)Nc2n1 |r|

C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

C[C@H]1COc2cccnc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

C[C@H]1C[C@H](C)O[C@@]2(CCC3=Cc4c(C[C@]23C)cnn4-c2ccc(F)cc2)O1 |t:9|

C[C@H]1C[C@H]2[C@@H]3CC[C@](OC(C)=O)(C(C)=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12 |r,t:28|

C[C@H]1Nc2cc3[nH]c(=O)cc(c3cc2[C@H]1C)C(F)(F)F

C[C@H]1OC2(CCC3=Cc4c(C[C@]23C)cnn4-c2ccc(F)cc2)O[C@@H]1C |t:6|

C[C@](C1CC1)(c1c[nH]c2c(NS(C)(=O)=O)cccc12)c1ccc(F)cc1

C[C@](C1CC1)(c1c[nH]c2c(NS(C)(=O)=O)cccc12)c1ccc(F)cc1F

C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3C=C[C@]12C |r,c:16,19,t:9|

C[C@]12CCCC(C)(C)[C@H]1Nc1cc3[nH]c(=O)cc(c3cc21)C(F)(F)F

C[C@]12CCCC[C@H]1Nc1cc3[nH]c(=O)cc(c3cc21)C(F)(F)F

C[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4C=C[C@H]3[C@@H]1CC[C@]21OCC=C1 |r,c:10,13,25|

C[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4C[C@@H](C=C)[C@H]3[C@@H]1CC[C@]21OCC=C1 |r,c:10,27|

C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC1(CC1)[C@]21OCC=C1 |r,c:28,t:8|

C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@]21OCC=C1 |r,c:25,t:8|

C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@]2(O)C\C=C\CC(F)(C(F)(F)F)C(F)(F)F |r|

C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@]2(O)\C=C\CC(F)(F)C(F)(F)C(F)(F)F |r|

C[C@]12CC[C@H]3[C@@H]([C@H]4C[C@H]4C4=CC(=O)CC[C@]34C)[C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 |r,t:10|

C[C@]12CCc3cc(ccc3C1=NN([C@H]2C1CCCC1)c1ccc(C#N)c(Cl)c1)C(O)=O |r,c:12|

C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO |r,t:9|

C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(OC(=O)C1CCCC1)C(=O)CO |r,t:9|

C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(OC(=O)Cc1ccccc1)C(=O)CO |r,t:9|

C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(OC(=O)c1ccccc1)C(=O)CO |r,t:9|

C[C@]12Cc3cnn(c3C=C1CCC21OCCO1)-c1ccc(F)cc1 |c:9|

C[C@]12Cc3cnn(c3C=C1CCC21O[C@H](C=C)[C@H](O1)C=C)-c1ccc(F)cc1 |c:9|

C[C@]12Cc3cnn(c3C=C1CCCC21OCCO1)-c1ccc(F)cc1 |c:9|

C[C@]12Cc3cnn(c3C=C1CCCC21O[C@H](C=C)[C@H](O1)C=C)-c1ccc(F)cc1 |c:9|

C\C(c1cccc(NS(C)(=O)=O)c1)=C1\c2ccccc2COc2ccccc12

Cc1[nH]c(C(=O)Nc2ccc(cc2)S(C)(=O)=O)c(C)c1-c1ccccc1C(F)(F)F |(13.84,-26.46,;12.94,-25.22,;11.4,-25.22,;10.92,-23.75,;9.46,-23.29,;9.14,-21.78,;8.32,-24.31,;6.85,-23.83,;6.53,-22.32,;5.07,-21.86,;3.93,-22.88,;4.26,-24.4,;5.72,-24.86,;2.46,-22.4,;2.14,-20.9,;.92,-22.39,;1.69,-23.73,;12.17,-22.84,;12.17,-21.31,;13.41,-23.75,;14.88,-23.29,;16.01,-24.31,;17.48,-23.84,;17.8,-22.33,;16.65,-21.31,;15.19,-21.78,;14.04,-20.75,;12.58,-21.24,;12.94,-19.65,;14.36,-19.25,)|

Cc1[nH]nc(c1-c1ccc(F)cc1)-c1ccc2OCC(=O)Nc2c1

Cc1c(NS(C)(=O)=O)cccc1N(Cc1ccc(Oc2ccc(Cl)c(OCC(O)=O)c2)cc1)Cc1ccc(F)cc1F

Cc1c(NS(C)(=O)=O)cccc1N(Cc1ccccc1)Cc1ccc(Cl)cc1F

Cc1c(NS(C)(=O)=O)cccc1N(Cc1ccccc1)Cc1ccc(Oc2ccc(OCC(O)=O)cc2)cc1

Cc1c(NS(C)(=O)=O)cccc1N(Cc1ccccc1)Cc1ccc(Oc2cccc(OCCCC(=O)NCCCC(O)=O)c2)cc1

Cc1c(NS(C)(=O)=O)cccc1N(Cc1ccccc1)Cc1ccccc1

Cc1c(N[C@@H]2CCCC[C@@]2(C)O)ccc(C#N)c1Cl |r|

Cc1c(N[C@@H]2CCC[C@@]2(C)O)ccc(C#N)c1Cl |r|

Cc1c(N[C@@H]2CCC[C@]2(C)O)ccc(C#N)c1Cl |r|

Cc1c(N[C@@H]2COC[C@@]2(C)O)ccc(C#N)c1Cl |r|

Cc1c(cc(CCF)n1-c1ccc(F)cc1OC(F)F)C(=O)Nc1ccc(cc1)S(C)(=O)=O |(49.68,-18.43,;49.68,-19.97,;48.44,-20.87,;48.91,-22.34,;50.45,-22.34,;51.35,-23.59,;50.72,-24.99,;51.63,-26.24,;50.93,-20.87,;52.39,-20.4,;53.53,-21.43,;54.99,-20.96,;55.32,-19.45,;56.78,-18.98,;54.16,-18.42,;52.7,-18.9,;51.56,-17.87,;51.87,-16.36,;50.72,-15.34,;53.33,-15.88,;46.97,-20.4,;46.65,-18.89,;45.83,-21.43,;44.36,-20.95,;44.05,-19.45,;42.59,-18.97,;41.44,-20,;41.77,-21.51,;43.23,-21.98,;39.97,-19.52,;38.83,-20.56,;39.19,-18.18,;40.74,-18.18,)|

Cc1c(cc(CCO)n1-c1ccc(Cl)cc1C(F)(F)F)C(=O)Nc1ccc(cc1)S(C)(=O)=O |(72.44,-4.78,;72.44,-6.32,;71.2,-7.22,;71.67,-8.69,;73.21,-8.69,;74.12,-9.93,;73.49,-11.34,;74.39,-12.59,;73.69,-7.22,;75.16,-6.75,;76.29,-7.78,;77.76,-7.31,;78.08,-5.8,;79.55,-5.33,;76.93,-4.77,;75.47,-5.25,;74.32,-4.22,;74.64,-2.71,;72.86,-4.7,;73.22,-3.12,;69.74,-6.75,;69.42,-5.24,;68.59,-7.78,;67.13,-7.3,;66.82,-5.8,;65.35,-5.32,;64.21,-6.35,;64.54,-7.86,;66,-8.33,;62.74,-5.87,;61.6,-6.91,;61.96,-4.53,;63.51,-4.53,)|

Cc1c(cn(CCO)c1-c1ccccc1C(F)(F)F)C(=O)Nc1ccc(cc1)S(C)(=O)=O |(34.95,-31.12,;34.48,-32.58,;33,-33.06,;33.01,-34.59,;34.47,-35.07,;34.85,-36.57,;33.75,-37.64,;34.13,-39.14,;35.38,-33.82,;36.92,-33.83,;37.69,-32.5,;39.22,-32.5,;40,-33.83,;39.22,-35.17,;37.68,-35.17,;36.92,-36.49,;35.38,-36.49,;37.68,-37.83,;36.13,-37.83,;31.76,-32.15,;31.76,-30.61,;30.43,-32.92,;29.09,-32.16,;27.76,-32.93,;26.42,-32.16,;26.42,-30.61,;27.75,-29.84,;29.08,-30.6,;25.09,-29.84,;25.08,-28.3,;24.31,-31.17,;23.55,-29.84,)|

Cc1c[nH]c2c(cccc12)-c1c(F)cc2NC(C)(C)C\C(=N/OC(C)(C)C)c2c1F |(3.75,-23.11,;5.09,-23.89,;5.72,-25.3,;7.25,-25.14,;7.58,-23.63,;8.91,-22.86,;8.91,-21.31,;7.58,-20.54,;6.25,-21.31,;6.24,-22.85,;10.24,-23.63,;10.23,-25.17,;8.9,-25.94,;11.55,-25.94,;12.88,-25.19,;14.21,-25.96,;15.55,-25.21,;16.87,-24.43,;16.87,-25.97,;15.56,-23.67,;14.23,-22.88,;14.24,-21.34,;15.58,-20.58,;15.58,-19.05,;16.92,-18.29,;14.26,-18.27,;15.57,-17.51,;12.9,-23.64,;11.57,-22.87,;11.57,-21.33,)|

Cc1c[nH]c2c(cccc12)-c1c(F)cc2NC(C)(C)C\C(=N/OC(C)(C)CO)c2c1F |(21.47,-47.3,;22.8,-48.07,;23.43,-49.48,;24.97,-49.32,;25.29,-47.81,;26.63,-47.04,;26.63,-45.5,;25.29,-44.72,;23.96,-45.5,;23.95,-47.04,;27.95,-47.82,;27.95,-49.35,;26.61,-50.12,;29.27,-50.12,;30.6,-49.37,;31.92,-50.15,;33.26,-49.39,;34.58,-48.61,;34.58,-50.15,;33.28,-47.85,;31.94,-47.06,;31.95,-45.52,;33.29,-44.77,;33.3,-43.23,;31.97,-42.45,;33.29,-41.69,;34.63,-42.47,;35.96,-43.25,;30.61,-47.83,;29.28,-47.05,;29.28,-45.51,)|

Cc1cc(-c2ccc3OCC(=O)Nc3c2)n(n1)-c1ccc(F)cc1

Cc1cc(-c2ccc3OCC(=O)Nc3c2)n(n1)-c1ccccc1

Cc1cc(C(=O)NCCc2ccccc2)c(C)n1-c1ccccc1C(F)(F)F |(19.51,-51.45,;18.61,-50.2,;17.07,-50.2,;16.59,-48.74,;15.13,-48.26,;14.81,-46.76,;13.98,-49.29,;12.52,-48.82,;11.38,-49.85,;11.7,-51.35,;10.55,-52.38,;10.87,-53.89,;12.34,-54.36,;13.48,-53.32,;13.16,-51.82,;17.84,-47.83,;17.83,-46.29,;19.08,-48.74,;20.55,-48.26,;21.69,-49.3,;23.15,-48.82,;23.47,-47.32,;22.32,-46.28,;20.86,-46.76,;19.71,-45.73,;20.03,-44.23,;18.25,-46.22,;18.61,-44.63,)|

Cc1cc(C(=O)Nc2ccc(C)c(Cl)c2)c(C)n1-c1ccccc1C(F)(F)F |(36.06,-52.56,;35.16,-51.31,;33.62,-51.31,;33.15,-49.85,;31.68,-49.37,;31.36,-47.87,;30.54,-50.4,;29.07,-49.93,;28.76,-48.42,;27.3,-47.94,;26.15,-48.98,;24.69,-48.5,;26.48,-50.49,;25.34,-51.52,;27.94,-50.96,;34.39,-48.94,;34.38,-47.4,;35.64,-49.85,;37.1,-49.37,;38.24,-50.41,;39.7,-49.93,;40.03,-48.43,;38.87,-47.39,;37.41,-47.87,;36.26,-46.85,;36.58,-45.34,;34.8,-47.33,;35.16,-45.74,)|

Cc1cc(C(=O)Nc2ccc(cc2)S(N)(=O)=O)c(C)n1-c1ccccc1C(F)(F)F |(69.74,-52.29,;68.83,-51.05,;67.29,-51.05,;66.82,-49.58,;65.36,-49.11,;65.04,-47.6,;64.21,-50.14,;62.75,-49.66,;61.62,-50.69,;60.16,-50.22,;59.83,-48.71,;60.97,-47.68,;62.43,-48.15,;58.36,-48.23,;58.04,-46.73,;57.58,-49.56,;56.82,-48.22,;68.06,-48.67,;68.06,-47.13,;69.31,-49.58,;70.78,-49.11,;71.91,-50.14,;73.38,-49.67,;73.7,-48.16,;72.55,-47.13,;71.09,-47.61,;69.94,-46.58,;70.26,-45.07,;68.48,-47.06,;68.84,-45.48,)|

Cc1cc(C(=O)Nc2cccc3ccccc23)c(C)n1-c1ccccc1C(F)(F)F |(51.15,-52.19,;50.24,-50.94,;48.7,-50.94,;48.23,-49.48,;46.77,-49,;46.45,-47.5,;45.62,-50.03,;44.16,-49.56,;43.03,-50.59,;41.56,-50.12,;41.24,-48.61,;42.38,-47.58,;42.06,-46.08,;43.19,-45.06,;44.66,-45.53,;44.98,-47.03,;43.84,-48.05,;49.47,-48.57,;49.47,-47.03,;50.72,-49.48,;52.19,-49.01,;53.32,-50.04,;54.79,-49.57,;55.11,-48.06,;53.96,-47.02,;52.5,-47.5,;51.35,-46.48,;51.67,-44.97,;49.89,-46.96,;50.25,-45.37,)|

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(CNc1ccccc1)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(COc1ccccc1)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(CSc1ccccc1)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cc1c[nH]c2c(C)cccc12)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cc1c[nH]c2c(cc(C)cc12)C#N)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cc1c[nH]c2c(cccc12)C#N)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cc1c[nH]c2cc(ccc12)C#N)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cc1c[nH]c2ccc(cc12)C#N)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cc1c[nH]c2cccc(C#N)c12)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cc1c[nH]c2cccc(C)c12)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cc1c[nH]c2ccccc12)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cn1cc(C#N)c2ccccc12)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cn1ccc2c(cccc12)C#N)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cn1ccc2ccccc12)C(F)(F)F

Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(Cn1ccc2ncccc12)C(F)(F)F

Cc1cc(Cl)ccc1C1=CC(C)(C)Oc2cc(NS(C)(=O)=O)ccc12 |t:9|

Cc1cc(F)ccc1-n1nc(cc1-c1cc(Cl)c2OCC(=O)Nc2c1)C(F)(F)F

Cc1cc(F)ccc1-n1nc(cc1-c1cc(F)c2OCC(=O)Nc2c1)C(F)(F)F

Cc1cc(F)ccc1-n1nc(cc1-c1ccc2OCC(=O)Nc2c1)C(F)(F)F

Cc1cc(F)ccc1-n1nccc1-c1ccnc(NC(N)=O)c1

Cc1cc(F)ccc1C1=C(COC1=O)c1ccc2OCC(=O)Nc2c1 |t:9|

Cc1cc(F)ccc1CCc1ccnc(NC(N)=O)c1

Cc1cc(NS(C)(=O)=O)cc2OC(C)(C)N=C(c3ccc(F)cc3)c12 |t:15|

Cc1cc(c(Cl)c2c1NC(C)(C)C(O)C2(C)C)-c1cccc2cc[nH]c12

Cc1cc(cc2NC(=O)COc12)-c1cc(nn1-c1ccc(F)cc1C)C(F)(F)F

Cc1cc(ccc1C#N)N1N=C(CC1c1ccc(F)cc1)c1ccc(cc1)C(O)=O |c:11|

Cc1cc(ccc1C#N)N1N=C2[C@@H](OCc3cc(ccc23)C(O)=O)[C@H]1C1CCCC1 |r,c:11|

Cc1cc(ccc1C#N)N1N=C2[C@H](CCc3cc(ccc23)C(O)=O)[C@@H]1C1CCCC1 |r,c:11|

Cc1cc(ccc1C#N)N1N=C2[C@H](OCc3cc(ccc23)C(O)=O)[C@@H]1C1CCCC1 |r,c:11|

Cc1cc(sc1-c1ccc2NC(C)(C)C(=O)C(C)(C)c2c1)C#N

Cc1cc(sc1-c1ccc2NC(C)(C)C=C(C)c2c1)C#N |t:15|

Cc1cc2CCOc2c(c1)C(C)(C)CC(O)(Cc1cc2ccccc2[nH]1)C(F)(F)F

Cc1ccc(CCc2ccnc(NC(N)=O)c2)cc1

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cc(nnc2[nH]1)-c1ccccc1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ccncc2[nH]1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cnccc2[nH]1)C(C)(C)C

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cnccc2[nH]1)C1CC1

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2cnncc2[nH]1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2nc(cnc2[nH]1)-c1ccccc1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2nc(ncc2[nH]1)-c1ccccc1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2nc(ncc2[nH]1)-c1cccnc1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2nc(ncc2[nH]1)N1CCCC1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2nc(ncc2[nH]1)N1CCOCC1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2nc(ncc2[nH]1)N1CCS(=O)(=O)CC1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2nccnc2[nH]1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2ncncc2[nH]1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cc1cc2nnccc2[nH]1)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)CC(O)(Cn1ccc(=O)c2ccccc12)C(F)(F)F

Cc1ccc(F)cc1C(C)(C)C[C@@](O)(Cc1cc2cnccc2[nH]1)C(C)(C)C |r|

Cc1ccc(F)cc1C(C)(C)C[C@@](O)(Cc1cc2ncncc2[nH]1)C(F)(F)F |r|

Cc1ccc(F)cc1C(C)(C)C[C@@](O)(Cc1cc2nnccc2[nH]1)C(F)(F)F |r|

Cc1ccc(F)cc1C(C)(C)C[C@](O)(Cc1cc2cnccc2[nH]1)C(C)(C)C |r|

Cc1ccc(O)c(c1)C(C)(C)CC(O)(Cn1ccc(=O)c2ccccc12)C(F)(F)F

Cc1ccc(O)cc1C(C)(C)CC(O)(Cn1ccc(=O)c2ccccc12)C(F)(F)F

Cc1ccc(c(c1)C(N)=O)C(C)(C)CC(O)(Cc1cc2cc(ncc2[nH]1)S(C)(=O)=O)C(F)(F)F

Cc1ccc(cc1)-n1nc(cc1-c1ccc2OCC(=O)Nc2c1)C(F)(F)F

Cc1ccc(cc1)-n1nccc1-c1ccnc(NC(N)=O)c1

Cc1ccc(cc1)C(=O)CC(Nc1ccc(cc1)[N+]([O-])=O)c1cccc(F)c1

Cc1ccc(cc1)C(O)Cc1ccnc(NC(N)=O)c1

Cc1ccc(cc1)C1CCCCN1S(=O)(=O)c1ccc2OCC(=O)Nc2c1

Cc1ccc2N(C(=O)c3ccc4OCC(=O)Nc4c3)[C@@](C)(CS(C)(=O)=O)COc2c1 |r|

Cc1ccc2[nH]cc(CC(NS(=O)(=O)c3c(C)cc(C)cc3C)C(F)(F)F)c2c1

Cc1ccc2c(CC(NS(=O)(=O)c3c(C)cc(C)cc3C)C(F)(F)F)c[nH]c2c1

Cc1ccc2c(NCC(O)(CC(C)(C)c3cc(F)ccc3O)C(F)(F)F)cccc2n1

Cc1cccc(CCc2ccnc(NC(N)=O)c2)c1

Cc1cccc(c1)-c1ccc2OCC(=O)Nc2c1C

Cc1cccc(c1)-n1nccc1-c1ccnc(NC(N)=O)c1

Cc1ccccc1-n1nc(cc1-c1ccc2OCC(=O)Nc2c1)C(F)(F)F

Cc1ccccc1-n1nccc1-c1ccnc(NC(N)=O)c1

Cc1ccccc1C(C)(C)CC(O)(Cc1cc2ncncc2[nH]1)C(F)(F)F

Cc1ccccc1C(C)(C)CC(O)(Cn1ccc(=O)c2ccccc12)C(F)(F)F

Cc1ccccc1C(Cc1ccnc(NC(N)=O)c1)C1CC1

Cc1ccccc1C(Cc1ccnc(NC(N)=O)c1)c1ccccc1

Cc1ccccc1CC(C)(O)c1ccnc(NC(N)=O)c1

Cc1ccccc1CCc1ccnc(NC(N)=O)c1

Cc1cn(c(C)n1)-c1ccc(CNS(=O)(=O)c2cc(F)ccc2F)cc1

Cc1nc(C)c(s1)C1=NN([C@H](C1)c1ccc(F)cc1)c1ccc(cc1)C#N |r,t:8|

Cc1nc(c([nH]1)-c1ccc2OCC(=O)Nc2c1)-c1ccccc1

Cc1nc(c(s1)-c1ccccc1)-c1ccc2OCC(=O)Nc2c1

Cc1nc(ccc1C#N)N1N=C(C[C@@H]1C1CCCC1)c1ccc(cc1)C(O)=O |r,c:11|

Cc1ncc2c(N[C@H]3c4ccc(F)c(O)c4C(C)(C)C[C@]3(O)C(F)(F)F)cc(F)cc2n1 |r|

Cc1nccn1-c1ccc(CNS(=O)(=O)c2c(C)cc(C)cc2C)cc1

Cc1nccn1-c1ccc(CNS(=O)(=O)c2cc(F)ccc2F)cc1

Cc1nccn1-c1ccc(CNS(=O)(=O)c2cc(F)ccc2F)cc1F

Cc1nccn1-c1ccc(CNS(=O)(=O)c2ccc(F)cc2F)cc1

Cc1nccn1-c1ccc(CNS(=O)(=O)c2ccccc2C)cc1

Cc1nccn1-c1ccc(CNS(=O)(=O)c2ccccc2Cl)cc1

Cc1nccn1-c1ccc(CNS(=O)(=O)c2ccccc2F)cc1

Cc1nn(C)c(c1-c1cc(C)c2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(C)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(C)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1F |(36.03,-29.04,;37.44,-28.41,;38.77,-29.18,;39.91,-28.15,;41.42,-28.47,;39.28,-26.74,;37.76,-26.9,;36.72,-25.76,;37.2,-24.3,;36.17,-23.15,;34.67,-23.47,;33.64,-22.32,;32.13,-22.65,;31.65,-24.11,;30.15,-24.43,;32.68,-25.25,;34.19,-24.94,;35.22,-26.08,;40.05,-25.41,;39.28,-24.07,;40.05,-22.74,;41.59,-22.74,;42.36,-21.41,;42.36,-24.07,;41.59,-25.41,;42.36,-26.74,)|

Cc1nn(CC(F)(F)CCO)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(CC(F)(F)CO)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(CCC#N)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(CCC(C)(F)F)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(CCC(F)(F)CO)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(CCCC(F)(F)F)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(CCCCO)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(CCCO)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(CCNS(C)(=O)=O)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(Cc2ccccc2)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(Cc2ccccn2)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(Cc2cccnc2)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(Cc2ccncc2)c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1

Cc1nn(c(c1-c1ccc2OCC(=O)Nc2c1)-c1ccc(F)cc1)-c1ccccc1

Cc1noc(=O)c2ccc(NC(=O)C(O)(CC(C)(C)c3cc(F)ccc3O)C(F)(F)F)cc12

Cc1noc(=O)c2ccc(NC(=O)C(O)(CC(C)(C)c3cccc4CCOc34)C(F)(F)F)cc12

Cc1noc(=O)c2ccc(NC(=O)C(O)(CC3CCCCC3)CC(C)(C)c3cc(F)ccc3O)cc12

Cc1noc(=O)c2ccc(NC(=O)C(O)(Cc3ccccc3)CC(C)(C)c3cc(F)ccc3O)cc12

Cc1noc(C)c1-c1cc2c(NC(C)(C)C(=O)C2(C)C)c2CCCc12 |(2.54,-4.54,;3.47,-3.72,;4.98,-4.05,;5.76,-2.71,;4.73,-1.56,;4.98,-.35,;3.33,-2.19,;2.01,-1.4,;.66,-2.12,;-.68,-1.4,;-.68,.15,;-2.01,.93,;-3.37,.15,;-4.42,-.49,;-3.33,1.39,;-3.37,-1.4,;-4.43,-2.04,;-2.01,-2.12,;-.91,-2.7,;-3.09,-2.71,;.66,.93,;.98,2.44,;2.53,2.61,;3.18,1.19,;2.01,.15,)|

Cc1noc(C)c1-c1cc2c(NC(C)(C)C(=O)C2(C)C)c2OCOc12 |(2.56,-4.56,;3.49,-3.74,;5.01,-4.07,;5.79,-2.72,;4.75,-1.57,;5,-.35,;3.35,-2.21,;2.02,-1.41,;.67,-2.13,;-.68,-1.41,;-.68,.15,;-2.02,.93,;-3.38,.15,;-4.45,-.49,;-3.35,1.39,;-3.38,-1.41,;-4.45,-2.05,;-2.02,-2.13,;-.92,-2.72,;-3.1,-2.73,;.67,.93,;.99,2.45,;2.55,2.62,;3.19,1.2,;2.02,.15,)|

Cc1noc(C)c1-c1cc2c(NC(C)(C)C(=O)C2(C)C)cc1Cl |(-3.24,3.89,;-4.16,3.07,;-5.67,3.39,;-6.44,2.05,;-5.41,.91,;-5.66,-.3,;-4.02,1.55,;-2.69,.77,;-1.33,1.54,;,.77,;,-.77,;1.33,-1.54,;2.67,-.77,;3.72,-.13,;2.64,-2,;2.67,.77,;3.74,1.39,;1.33,1.54,;.25,2.13,;2.42,2.13,;-1.33,-1.54,;-2.69,-.77,;-3.75,-1.39,)|

Cc1noc(C)c1-c1ccc(CNC(=O)c2cnc3n(C)nc(C)c3c2Cl)cc1

Cc1noc(C)c1-c1ccc2NC(C)(C)C(=O)C(C)(C)c2c1

Cc1noc(C)c1S(=O)(=O)NCc1ccc(cc1)-c1cccc(NS(C)(=O)=O)c1

Cc1noc(C)c1S(=O)(=O)NCc1ccc(cc1)-c1cccc(c1)C#N

Cc1noc(C)c1S(=O)(=O)NCc1ccc(cc1)-c1cccc(c1)C(N)=O

Cc1noc(C)c1S(=O)(=O)NCc1ccc(cc1)-c1ccccc1

Cc1noc(C)c1S(=O)(=O)NCc1ccc(cc1)-c1cccnc1

Cc1noc(C)c1S(=O)(=O)NCc1ccc(cc1)-c1cncc(c1)C#N

Cc1noc(C)c1S(=O)(=O)NCc1ccc(cc1)-n1ccnc1C

Cc1noc(C)c1S(=O)(=O)NCc1ccc(s1)-c1ccccc1

Cc1onc(c1-c1ccc(F)cc1)-c1ccc2OCC(=O)Nc2c1

Clc1cccc(Cc2c([nH]c(=O)[nH]c2=O)N2CCC(CC2)c2ccccc2)c1

Clc1cccc(c1)C1CCN(CC1)c1[nH]c(=O)[nH]c(=O)c1Cc1ccccc1

Clc1ccccc1Cc1c([nH]c(=O)[nH]c1=O)N1CCC(CC1)c1ccccc1

Cn1c(ccc1-c1cc2c(NC(=O)C2(C)C)c(F)c1)C#N

Cn1c(ccc1-c1ccc2NC(=O)COC(C)(c3ccco3)c2c1)C#N

Cn1c(ccc1-c1ccc2NC(=O)COC(C)(c3ccsc3)c2c1)C#N

Cn1c(ccc1-c1ccc2NC(=O)COC(c3ccco3)(c3ccco3)c2c1)C#N

Cn1c(ccc1-c1ccc2NC(=O)COC(c3cccs3)(c3cccs3)c2c1)C#N

Cn1c2cc3N[C@@H]4CCCC[C@@H]4c3cc2c(cc1=O)C(F)(F)F

Cn1cc(-c2ccc(cc2)C#N)c2ccc(NS(C)(=O)=O)cc12

Cn1cc(C(O)=O)c2ccc(cc12)N1CCC(CC1)OCc1c(onc1-c1c(Cl)cccc1Cl)C1CC1 |(2.14,2.41,;1.76,1.24,;2.66,.02,;1.76,-1.24,;2.24,-2.7,;1.42,-3.62,;3.45,-2.94,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;-3.71,1.53,;-5.05,.76,;-6.38,1.53,;-6.38,3.07,;-5.05,3.84,;-3.72,3.07,;-7.72,3.84,;-7.72,5.38,;-9.05,6.15,;-10.44,5.51,;-11.47,6.65,;-10.71,7.99,;-9.2,7.67,;-8.05,8.7,;-6.56,8.33,;-6.21,7.15,;-5.5,9.45,;-5.93,10.93,;-7.43,11.29,;-8.49,10.18,;-9.69,10.46,;-10.75,4,;-10.37,2.59,;-11.85,3.04,)|

Cn1cnc(c1-c1ccc(F)cc1)-c1ccnc(NC(N)=O)c1

Cn1cnc(c1-c1ccnc(NC(N)=O)c1)-c1ccc(F)cc1

Cn1ncc(c1-c1ccc(F)cc1)-c1ccc2OCC(=O)Nc2c1

FC(F)(F)C(Cc1c[nH]c2ccccc12)NS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl

FC(F)(F)C1CCNc2cc3oc(=O)cc(c3cc12)C(F)(F)F

FC(F)(F)c1cc(-c2ccc3OCC(=O)Nc3c2)n(n1)-c1ccc(Cl)cc1

FC(F)(F)c1cc(-c2ccc3OCC(=O)Nc3c2)n(n1)-c1ccccc1Cl

FC(F)(F)c1cc(=O)[nH]c2cc3N[C@@H]4CCCC[C@@H]4c3cc12

Fc1cc(cc(c1)-c1ccc2NC(=O)COC(c3ccco3)(c3ccco3)c2c1)C#N

Fc1ccc(C2=C(COC2=O)c2ccc3OCC(=O)Nc3c2)c(F)c1 |t:5|

Fc1ccc(cc1)-n1nc(cc1-c1ccc2OCC(=O)Nc2c1)C#N

Fc1ccc(cc1)-n1nc(cc1-c1ccc2OCC(=O)Nc2c1)C(F)(F)C(F)(F)F

Fc1ccc(cc1)-n1nc(cc1-c1ccc2OCC(=O)Nc2c1)C(F)(F)F

Fc1ccc(cc1)-n1ncc(c1-c1ccc2OCC(=O)Nc2c1)C(F)(F)F

Fc1ccc(cc1)C1=C(COC1=O)c1ccc2OCC(=O)Nc2c1 |t:8|

Fc1ccc(cc1)C1CC(=NN1c1ccc(cc1)C#N)c1ccc2[nH]c(=O)oc2c1 |c:10|

Fc1ccc(cc1)C1Sc2nncn2N=C1c1ccc2OCC(=O)Nc2c1 |c:16|

Fc1ccc(cc1)[C@@H]1CC(=NN1c1ccc(cc1)C#N)c1ccc2[nH]c(=O)oc2c1 |r,c:10|

Fc1ccc(cc1)[C@H]1CC(=NN1c1ccc(cc1)C#N)c1ccc2[nH]c(=O)oc2c1 |r,c:10|

Fc1ccc2CCN(CCc2c1)c1ccc2OCC(=O)Nc2c1

Fc1ccc2c(OCc3ccccc3\C2=C/c2ccc3[nH]c(=O)[nH]c3c2)c1

Fc1ccc2c(OCc3ccccc3\C2=C/c2ccc3n([C@H]4C[C@H]5COCCN5C4)c(=O)[nH]c3c2)c1 |r|

Fc1cccc(c1)-n1nc(cc1-c1ccc2OCC(=O)Nc2c1)C(F)(F)F

Fc1cccc(c1)C1Sc2nncn2N=C1c1ccc2OCC(=O)Nc2c1 |c:16|

Fc1ccccc1-n1nc(cc1-c1ccc2OCC(=O)Nc2c1)C(F)(F)F

Fc1ccccc1C1Sc2nncn2N=C1c1ccc2OCC(=O)Nc2c1 |c:16|

N=C([C@@H](Sc1nnc[nH]1)c1ccccc1)c1ccc2OCC(=O)Nc2c1 |r|

NC(=O)C[C@H]1CNc2cc(Cl)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

NC(=O)C[C@H]1COCc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

NC(=O)C[C@H]1COc2cc(Cl)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

NC(=O)C[C@H]1COc2cc(F)c(cc2N1C(=O)c1ccc2OCC(=O)Nc2c1)C1CC1 |r|

NC(=O)C[C@H]1COc2cc(F)cc(F)c2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

NC(=O)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

NC(=O)Nc1cc(CC(C2CC2)c2ccccc2)ccn1

NC(=O)Nc1cc(CC(CCC#N)c2ccccc2)ccn1

NC(=O)Nc1cc(CC(O)c2cccc(F)c2)ccn1

NC(=O)Nc1cc(CC(c2ccccc2)c2ccccc2)ccn1

NC(=O)Nc1cc(CCc2ccc(F)c(c2)C(F)(F)F)ccn1

NC(=O)Nc1cc(CCc2ccc(F)cc2)ccn1

NC(=O)Nc1cc(CCc2ccc(cc2)C(F)(F)F)ccn1

NC(=O)Nc1cc(CCc2cccc(F)c2)ccn1

NC(=O)Nc1cc(CCc2cccc(c2)C(F)(F)F)ccn1

NC(=O)Nc1cc(CCc2ccccc2)ccn1

NC(=O)Nc1cc(CCc2ccccc2C(F)(F)F)ccn1

NC(=O)Nc1cc(CCc2ccccc2F)ccn1

NC(=O)Nc1cc(ccn1)-c1cc(nn1-c1ccc(F)cc1)C(F)(F)F

NC(=O)Nc1cc(ccn1)-c1cc(nn1-c1ccccc1)C(F)(F)F

NC(=O)Nc1cc(ccn1)-c1cc(nn1C1CCCC1)C(F)(F)F

NC(=O)Nc1cc(ccn1)-c1ccnn1-c1ccc(Cl)cc1

NC(=O)Nc1cc(ccn1)-c1ccnn1-c1ccc(F)cc1

NC(=O)Nc1cc(ccn1)-c1ccnn1-c1ccc(F)cc1Cl

NC(=O)Nc1cc(ccn1)-c1ccnn1-c1cccc(Cl)c1

NC(=O)Nc1cc(ccn1)-c1ccnn1-c1cccc(F)c1

NC(=O)Nc1cc(ccn1)-c1ccnn1-c1ccccc1

NC(=O)Nc1cc(ccn1)-c1ccnn1-c1ccccc1Cl

NC(=O)Nc1cc(ccn1)-c1ccnn1-c1ccccc1F

NC(=O)Nc1cc(ccn1)-c1ccnn1-c1nccs1

NC(=O)Nc1cc(ccn1)-c1ccnn1C1CCCC1

NC(=O)Nc1cc(ccn1)-c1ccnn1Cc1ccc(F)cc1

NC(=O)Nc1cc(ccn1)-c1nc[nH]c1-c1ccc(F)cc1

NC(=O)Nc1cc(ccn1)-c1ocnc1-c1ccc(F)cc1

NC(=O)Nc1cc(ccn1)C1=C(CCCC1)c1ccc(F)cc1 |t:11|

NC(=O)Nc1cc(ccn1)C1CCCCC1c1ccc(F)cc1

NC(=O)Nc1cc(ccn1)N1CCCC1c1ccc(F)cc1

NCC[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

NS(=O)(=O)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

NS(=O)(=O)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCCNc2c1 |r|

NS(=O)(=O)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2cc[nH]c2c1 |r|

Nc1cc(Cl)cc(Cl)c1S(=O)(=O)NC(Cc1c[nH]c2ccccc12)C(F)(F)F

O=C(N1CCCc2ccccc12)c1ccc2OCC(=O)Nc2c1

O=C(N1CCOc2ccccc12)c1ccc2OCC(=O)Nc2c1

O=C(N1[C@@H](CC#N)COc2ccccc12)c1ccc2OCC(=O)Nc2c1 |r|

O=C(NCc1ccccc1)[C@@]1(Cc2ccccc2)OC(=O)N(Cc2ccccc2)C1=O |r|

O=C(NCc1ccccc1)[C@]1(Cc2ccccc2)OC(=O)N(Cc2ccccc2)C1=O |r|

O=C(NCc1nccs1)[C@@]1(Cc2ccccc2)OC(=O)N(Cc2ccccc2)C1=O |r|

O=C1COc2ccc(cc2N1)C1=Nc2ccccc2SC1c1ccccc1 |t:13|

O=C1COc2ccc(cc2N1)C1=Nn2ccnc2SC1c1ccccc1 |t:13|

O=C1COc2ccc(cc2N1)C1=Nn2cnnc2SC1 |t:13|

O=C1COc2ccc(cc2N1)C1=Nn2cnnc2SC1Cc1ccccc1 |t:13|

O=C1COc2ccc(cc2N1)C1=Nn2cnnc2SC1c1ccccc1 |t:13|

O=C1COc2ccc(cc2N1)N1CCOC[C@H]1c1ccccc1 |r|

O=C1COc2ccc(nc2N1)N1CCOC[C@H]1c1ccccc1 |r|

O=C1COc2ccc(nc2N1)N1C[C@@H](CC#N)OC[C@H]1c1ccccc1 |r|

O=c1[nH]c(N2CCC(CC2)c2ccccc2)c(Cc2ccccc2)c(=O)[nH]1

OC(=O)C[C@H]1COc2cc(Cl)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

OC(=O)Cc1ccc(cc1)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1 |r,t:11|

OC(=O)c1ccc(cc1)C1=NN(C(C1)C1CCCC1)c1ccc(C#N)c(Cl)c1 |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)C1CCCC1)c1ccc(cc1)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)C1CCCCC1)c1ccc(cc1)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)c1ccc(C#N)c(Cl)c1 |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)c1ccc(C#N)c(F)c1 |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)c1ccc(C#N)c(c1)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)c1ccc(C#N)c(c1)C(F)(F)F |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)c1ccc(cc1)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)c1ccc(cc1Cl)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)c1ccc(cc1F)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)c1ccccc1 |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1cccc(F)c1)c1ccc(cc1)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1ccccn1)c1ccc(cc1)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1cccnc1)c1ccc(cc1)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1ccco1)c1ccc(cc1)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1cccs1)c1ccc(cc1)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(C1)c1ccncc1)c1ccc(cc1)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN(C(Cc2ccccc2)C1)c1ccc(cc1)C#N |t:10|

OC(=O)c1ccc(cc1)C1=NN([C@@H](C1)c1ccc(F)cc1)c1ccc(cc1)C#N |r,t:10|

OC(=O)c1ccc(cc1)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1 |r,t:10|

OC(=O)c1ccc(cc1)C1=NN([C@H](C1)c1ccc(F)cc1)c1ccc(C#N)c(Cl)c1 |r,t:10|

OC(=O)c1ccc(cc1)C1=NN([C@H](C1)c1ccc(F)cc1)c1ccc(cc1)C#N |r,t:10|

OC(=O)c1ccc(cc1)C1CC(=NN1c1ccc(cc1)C#N)c1ccc2[nH]c(=O)oc2c1 |c:12|

OC(=O)c1ccc(cc1)N1N=C(CC1c1ccc(F)cc1)c1ccc(cc1)C(O)=O |c:11|

OC(=O)c1ccc(cc1)N1N=C(CC1c1ccc(F)cc1)c1ccc2[nH]c(=O)oc2c1 |c:11|

OC(=O)c1ccc(cc1Cl)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1 |r,t:11|

OC(=O)c1ccc(cc1F)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1 |r,t:11|

OC(=O)c1ccc(cc1OC(F)(F)F)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1 |r,t:15|

OC(=O)c1ccc2C3=NN([C@@H](C4CC=CC4)[C@H]3CCc2c1)c1ccc(C#N)c(Cl)c1 |r,c:13,t:7|

OC(=O)c1ccc2C3=NN([C@@H](C4CCC4)[C@H]3CCc2c1)c1ccc(C#N)c(Cl)c1 |r,t:7|

OC(=O)c1ccc2C3=NN([C@@H](C4CCCC4)[C@H]3CCc2c1)c1ccc(C#N)c(Cl)c1 |r,t:7|

OC(=O)c1ccc2C3=NN([C@@H](C4CCCC4)[C@H]3CCc2c1)c1ccc(C#N)c(O)c1 |r,t:7|

OC(=O)c1ccc2C3=NN([C@@H](C4CCCC4)[C@H]3CCc2c1)c1ccc(C#N)c(OCc2ccccc2)c1 |r,t:7|

OC(=O)c1ccc2C3=NN([C@@H](C4CCCC4)[C@H]3CCc2c1)c1ccc(cc1)C#N |r,t:7|

OC(=O)c1ccc2C3=NN([C@@H](C4CCCC4)[C@H]3OCc2c1)c1ccc(C#N)c(Cl)c1 |r,t:7|

OC(=O)c1ccc2C3=NN([C@@H](C4CCCO4)[C@H]3CCc2c1)c1ccc(C#N)c(Cl)c1 |r,t:7|

OC(=O)c1ccc2C3=NN([C@@H]([C@@H]3CCc2c1)c1ccc(F)cc1)c1ccc(C#N)c(Cl)c1 |r,t:7|

OC(=O)c1ccc2C3=NN([C@H](C4CCCC4)[C@@H]3OCc2c1)c1ccc(C#N)c(Cl)c1 |r,t:7|

OC(=O)c1ccc2C3=NN([C@H]([C@H]3CCc2c1)C1OC=CC=C1)c1ccc(C#N)c(Cl)c1 |r,c:21,23,t:7|

OC(=O)c1ccc2C3=NN([C@H]([C@H]3CCc2c1)c1ccc(F)cc1)c1ccc(C#N)c(Cl)c1 |r,t:7|

OC(=O)c1ccc2C3=NN([C@H]([C@H]3CCc2c1)c1ccc(F)cc1)c1ccc(cc1)C#N |r,t:7|

OC(=O)c1ccc2C3=NN([C@H]([C@H]3Cc2c1)c1ccc(F)cc1)c1ccc(cc1)C#N |r,t:7|

OC(=O)c1ccc2C3=NN([C@H]([C@H]3OCc2c1)c1ccc(F)cc1)c1ccc(C#N)c(Cl)c1 |r,t:7|

OCCCOc1cc(ccc1C(O)=O)C1=NN([C@H](C1)C1CCCC1)c1ccc(C#N)c(Cl)c1 |r,t:15|

OCC[C@H]1COc2cc(F)c(CC3CCCCC3)cc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

OCC[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

OCC[C@H]1Cc2cc(Cl)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1 |r|

OC[C@@H]1CN([C@@H](CO1)c1ccccc1)c1ccc2OCC(=O)Nc2n1 |r|

OCc1cc(-c2ccc3OCC(=O)Nc3c2)n(n1)-c1ccc(F)cc1

Oc1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)c1ccc(cc1)[N+]([O-])=O |t:8|

[#6]-[#6]-1=[#6]C([#6])([#6])[#7]-c2ccc3-c4cc(F)ccc4-[#8]\[#6](=[#6]-4/[#16]-[#6]-[#6]-[#6]-[#16]-4)-c3c-12 |t:1|

[#6]S(=O)(=O)[#7]-c1cccc(\[#6]=[#6]-2/c3ccccc3-[#6]-[#6]-c3ccccc-23)c1

[#6]\[#6](-[#6])=[#6]\[#6]=[#6]-1/[#8]-c2ccc(F)cc2-c2ccc3-[#7]C([#6])([#6])[#6]=[#6](-[#6])-c3c-12 |t:23|

[H][C@@]1(CCCC2=Cc3c(C[C@]12C)cnn3-c1ccc(F)cc1)[C@@H](O)CCC=C |r,t:5|

[H][C@@]1(CCCC2=Cc3c(C[C@]12C)cnn3-c1ccc(F)cc1)[C@@H](O)c1cc(F)c(F)c(OC)c1 |r,t:5|

[H][C@@]1(CCCC2=Cc3c(C[C@]12C)cnn3-c1ccc(F)cc1)[C@@H](O)c1ccc(F)cc1 |r,t:5|

[H][C@@]1(CCCC2=Cc3c(C[C@]12C)cnn3-c1ccc(F)cc1)[C@@H](O)c1ccccc1 |r,t:5|

[H][C@@]1(CCCC2=Cc3c(C[C@]12C)cnn3-c1ccc(F)cc1)[C@H](O)c1ccc(F)cc1 |r,t:5|

[H][C@@]1(CCCC2=Cc3c(C[C@]12C)cnn3-c1ccc(F)cc1)[C@](C)(O)c1ccc(F)cc1 |r,t:5|

[H][C@@]12CC(=O)C(=CC)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |w:6.6,t:20|

[H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)CC=C1[C@@]2([H])CCC2=CC(=O)CC[C@]12Cc1ccc(C)cc1 |r,c:13,t:20|

[H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)C[C@@H](C1=C3CCC(=O)C=C3CC[C@@]21[H])c1ccc(cc1)N(C)C |r,c:14,20|

[H][C@@]12CC[C@H](C(=O)CO)[C@]1(C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C)C=O |t:21|

[H][C@@]12CC[C@H](C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |r,t:20|

[H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([H])CC(=O)CC[C@]12C |r|

[H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)C=C[C@]12C |r,c:27,t:23|

[H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |t:23|

[H][C@@]12C[C@@H](C)[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C |c:28,t:24|

[H][C@]12CN(CCC(C)C)C[C@@]1(C(=O)SCF)[C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]([H])(C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@]1([H])C2 |r,c:33,t:29|

[H][C@]12CN(Cc3ccc(CSc4ccc(O)cc4)cc3)C[C@@]1(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]([H])(C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@]1([H])C2 |r,c:45,t:41|

[H][C@]12CN(Cc3ccc(cc3)C(F)(F)F)C[C@@]1(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]([H])(C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@]1([H])C2 |r,c:39,t:35|

[H][C@]12CN(Cc3cccc(Cl)c3)C[C@@]1(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]([H])(C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@]1([H])C2 |r,c:36,t:32|

[H][C@]12CN(Cc3cccc(Cl)c3)C[C@@]1(C(=O)SCF)[C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]([H])(C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@]1([H])C2 |r,c:37,t:33|

[H][C@]12CN(Cc3ccccc3)C[C@@]1(C(=O)N(C)C)[C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]([H])(C[C@H](F)C4=CC(=O)C=C[C@]34C)[C@]1([H])C2 |r,c:36,t:32|

[H][C@]12C[C@@H](CN1CCOC2)n1c2ccc(\C=C3\c4ccc(F)cc4OCc4c(F)cccc34)cc2[nH]c1=NC#N |r|

[H][C@]12C[C@H](CN1CCOC2)n1c2ccc(\C=C3/c4ccccc4COc4cc(F)ccc34)cc2[nH]c1=O |r|