133 SMILES Strings for Activin receptor type-1 [147-509]

Compound Name
SMILES String
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1[C@@H](C)CCC[C@H]1C |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1[C@@H](C)COC[C@H]1C |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1CC2 |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1[C@H]2C[C@H](O)[C@@H]1CCC2 |r,THB:19:22:28.29.30:24.25|
CC(C)C(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(nc3)N3CCN[C@H](C)C3)c2n1 |r|
COCC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(nc3)N3CCN[C@H](C)C3)c2n1 |r|
CC(C)NC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(nc3)N3CCN[C@H](C)C3)c2n1 |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1[C@@H](C)CN(C[C@H]1C)C(=O)N(C)C |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1[C@@H](C)CN(C[C@H]1C)C(=O)N1CCCC1 |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1[C@@H](C)CN(C[C@H]1C)C(=O)N1CCC(F)C1 |r|
CCOC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(nc3)N3CCN[C@H](C)C3)c2n1 |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1[C@@H](C)CN(C[C@H]1C)C(=O)OCCF |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1CN(C2)C(=O)C1CC1 |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1CN(C2)C(=O)N1CCCC1 |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1CN(C2)c1ccc(cc1)C#N |r|
C[C@H]1CCC[C@@H](C)N1c1ncc2[nH]nc(-c3ccc(cc3)N3CCN(C)CC3)c2n1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(nc3)N3CCN[C@H](C)C3)c2n1 |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1CCc2c(C1)ncn2C |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1CCn2c(C)cnc2C1 |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1CC2CCC1CN2C(=O)N1CCCC1 |r|
C[C@@H]1CN(CCN1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1C[C@@H]2C[C@H]1CN2C(=O)N1CCCC1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(cc3)N3CCN(C)CC3)c2n1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(N4CCN(C)CC4)c(F)c3)c2n1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(nc3)N3CCN(C)CC3)c2n1 |r|
CCN1CCN(CC1)c1ccc(cc1C)-c1n[nH]c2cnc(nc12)N1[C@@H](C)CN(C[C@H]1C)C(=O)OC |r|
CNC(=O)c1ccc(cc1)-c1n[nH]c2cnc(nc12)N1[C@@H](C)CN(C[C@H]1C)C(=O)OC |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(cc3)C3CCN(C)C3)c2n1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(cc3)C3CCN(CCO)C3)c2n1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(cc3)N3CCN(CC3)C(C)CO)c2n1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(cc3)N3CCN(CC3)C3CCOCC3)c2n1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(cc3)N3CCN(CC3)C(C)(C)C(O)=O)c2n1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(nc3)N3CCO[C@H](C)C3)c2n1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(nc3)N3CCN(C)[C@H](C)C3)c2n1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(cc3)N3CCC(O)CC3)c2n1 |r|
COC(=O)N1C[C@H](C)N([C@H](C)C1)c1ncc2[nH]nc(-c3ccc(cc3)N3CCN4C[C@@H](O)C[C@@H]4C3)c2n1 |r|
CN1CCN(CC1=O)c1ncc2[nH]nc(-c3cnn(C)c3)c2n1
CC1N(CCN(C)C1=O)c1ncc2[nH]nc(-c3cnn(C)c3)c2n1
Cn1cc(cn1)-c1n[nH]c2cnc(nc12)N1CCc2ncccc2C1
Cn1cc(cn1)-c1n[nH]c2cnc(nc12)N1CCn2cnc(c2C1)C(F)(F)F
Cn1cc(cn1)-c1n[nH]c2cnc(nc12)N1CCc2cn[nH]c2C1
Cn1cc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1c1cn[nH]c1C2
CN1CC2CCC(N2c2ncc3[nH]nc(-c4cnn(C)c4)c3n2)C1=O
Cn1cc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1C(=O)N(CCF)C2
CC(C)C(=O)N1CCC(CC1)n1cc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1C(=O)N(C)C2
CN1CC2CCC(N2c2ncc3[nH]nc(-c4cnn(CCN5CCOCC5)c4)c3n2)C1=O
CN1CC2CCC(N2c2ncc3[nH]nc(-c4cnn(Cc5ccncc5)c4)c3n2)C1=O
CN1CCN(CC1)c1ccc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1C(=O)N(C)C2
CCn1cc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1C(=O)N(C)C2
CN1CC2CCC(N2c2ncc3[nH]nc(-c4cnn(c4)C4CCC4)c3n2)C1=O
CN1CC2CCC(N2c2ncc3[nH]nc(-c4cnn(c4)-c4ccncc4)c3n2)C1=O
CN1CC2CCC(N2c2ncc3[nH]nc(-c4cnn(c4)-c4ccc(cc4)C#N)c3n2)C1=O
CN1CC2CCC(N2c2ncc3[nH]nc(-c4cnn(c4)-c4ccnc(C)c4)c3n2)C1=O
CN(C)c1ccc(cn1)-n1cc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1C(=O)N(C)C2
CN1CC2CCC(N2c2ncc3[nH]nc(-c4cnn(c4)-c4ccc5nccn5c4)c3n2)C1=O
CN1CC2CCC(N2c2ncc3[nH]nc(-c4cnn(c4)-c4ccc(C#N)c(C)c4)c3n2)C1=O
CN(C)C(=O)c1ccc(cc1)-n1cc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1C(=O)N(C)C2
CNC(=O)c1ccc(cc1F)-n1cc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1C(=O)N(C)C2
CNC(=O)c1ccc(cn1)-n1cc(cn1)-c1n[nH]c2cnc(nc12)N1C2CCC1C(=O)N(C)C2
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2ccccc12
COC(=O)c1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2ccccc12
C[C@]1(O)CC[C@@H](CC1)NC(=O)c1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2ccccc12 |r,wU:5.8,1.0,wD:1.1,(5.03,6.52,;4.63,5.03,;6.16,4.83,;3.3,5.8,;1.96,5.03,;1.96,3.49,;3.3,2.72,;4.63,3.49,;.63,2.72,;.63,1.18,;1.96,.41,;-.71,.41,;-2.04,1.18,;-3.37,.41,;-4.84,.89,;-5.74,-.36,;-4.84,-1.6,;-3.37,-1.13,;-2.04,-1.9,;-.71,-1.13,;.63,-1.9,;.63,-3.44,;1.96,-4.21,;3.3,-3.44,;3.3,-1.9,;1.96,-1.13,;4.63,-4.21,;4.63,-5.75,;5.96,-6.52,;7.3,-5.75,;7.3,-4.21,;5.96,-3.44,;-5.31,2.35,;-6.82,2.67,;-7.3,4.14,;-6.27,5.28,;-4.76,4.96,;-3.73,6.11,;-2.22,5.78,;-1.75,4.32,;-2.78,3.18,;-4.28,3.5,)|
CCOC(=O)N1CCN(CC1)C(=O)c1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2ccccc12
NC(=O)c1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2ccccc12
N#Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2ccccc12
OCc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2ccccc12
COCc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2ccccc12
Cc1nn2c(cnc2cc1-c1cnn(CC2CCNCC2)c1)-c1ccnc2cc(ccc12)-c1ccncc1
Cc1nn2c(cnc2cc1-c1cnn(c1)[C@H]1CC[C@H](O)CC1)-c1ccnc2cc(ccc12)-c1ccncc1 |r,wU:18.21,wD:15.17,(-.34,-1.71,;-1.67,-2.48,;-3,-1.71,;-4.34,-2.48,;-5.8,-2.01,;-6.71,-3.25,;-5.8,-4.5,;-4.34,-4.02,;-3,-4.79,;-1.67,-4.02,;-.34,-4.79,;-.18,-6.32,;1.33,-6.64,;2.1,-5.31,;1.07,-4.17,;3.64,-5.31,;4.41,-6.64,;5.95,-6.64,;6.72,-5.31,;8.26,-5.31,;5.95,-3.98,;4.41,-3.98,;-6.28,-.54,;-7.78,-.22,;-8.26,1.24,;-7.23,2.39,;-5.72,2.07,;-4.69,3.21,;-3.19,2.89,;-2.71,1.43,;-3.74,.28,;-5.25,.6,;-2.16,4.04,;-.65,3.72,;.38,4.86,;-.1,6.32,;-1.6,6.64,;-2.63,5.5,)|
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCN(CCO)CC1)-c1ccnc2cc(ccc12)-c1ccncc1
CN1CCN(C(=O)C1)c1ccc(cc1)-c1cc2ncc(-c3ccnc4cc(ccc34)-c3ccncc3)n2nc1C
CN1CCN(CC1)c1cccc(c1)-c1cc2ncc(-c3ccnc4cc(ccc34)-c3ccncc3)n2nc1C
CN1CCN(CC1)C(=O)c1ccc(cc1)-c1cc2ncc(-c3ccnc4cc(ccc34)-c3ccncc3)n2nc1C
C[C@@H]1CCCN1Cc1ccc(cc1F)-c1cc2ncc(-c3ccnc4cc(ccc34)-c3ccncc3)n2nc1C |r|
CNC(=O)c1ccc2c(ccnc2c1)-c1cnc2cc(c(C)nn12)-c1ccc(cc1)N1CCNCC1
CN1CCN(CC1)C(=O)c1ccc2c(ccnc2c1)-c1cnc2cc(c(C)nn12)-c1ccc(cc1)N1CCNCC1
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2cc(ccc12)-c1ccn(C)n1
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2cc(ccc12)-c1ccnc(CO)c1
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2cc(ccc12)N1CCOCC1
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2cc(ccc12)N1CC2(C1)CCOC2
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2cc(Nc3cccnc3)ccc12
CC(=O)N1CCN(CC1)c1ccc2c(ccnc2c1)-c1cnc2cc(c(C)nn12)-c1ccc(cc1)N1CCNCC1
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2cc(CN3CCOCC3)ccc12
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2cc(ccc12)C(O)c1cc(F)cc(F)c1
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2cc(CO)ccc12
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2ncccc12
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccc(C#N)c2ncccc12
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2OCCOc12
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2cc(ccc12)C#N
Cc1nn2c(cnc2cc1-c1ccc(cc1)N1CCNCC1)-c1ccnc2c(cccc12)C(=O)NCCO
Cc1nn2c(cnc2cc1-c1cnn(c1)C1CCOCC1)-c1ccnc2N(CCc12)C(=O)c1ccncc1
CC(=O)N1C[C@@H]2C[C@H]1CN2c1ccc2c(ccnc2c1)-c1cnc2cc(-c3cnn(c3)[C@H]3CC[C@H](O)CC3)c(C)nn12 |r,wU:31.35,wD:34.39,7.6,5.5,(2.46,6,;.95,6.32,;.48,7.79,;-.08,5.18,;.4,3.72,;-.63,2.57,;-.81,4.17,;-1.58,5.5,;-2.62,4.36,;-2.14,2.89,;-3.17,1.75,;-2.69,.28,;-3.72,-.86,;-5.23,-.54,;-6.26,-1.69,;-7.77,-1.37,;-8.24,.1,;-7.21,1.24,;-5.71,.92,;-4.68,2.07,;-5.79,-3.15,;-6.69,-4.4,;-5.79,-5.64,;-4.32,-5.17,;-2.99,-5.94,;-1.65,-5.17,;-.32,-5.94,;-.16,-7.47,;1.35,-7.79,;2.12,-6.46,;1.09,-5.31,;3.65,-6.29,;4.28,-4.89,;5.81,-4.73,;6.71,-5.97,;8.24,-5.81,;6.09,-7.38,;4.55,-7.54,;-1.65,-3.63,;-.32,-2.86,;-2.99,-2.86,;-4.32,-3.63,)|
Cc1nn2c(cnc2cc1-c1cnn(c1)[C@H]1CC[C@H](O)CC1)-c1ccnc2cc(ccc12)N1CCN2C(CCC2=O)C1 |r,wU:15.17,wD:18.21,(-.32,-2.78,;-1.65,-3.55,;-2.99,-2.78,;-4.32,-3.55,;-5.79,-3.07,;-6.69,-4.32,;-5.79,-5.56,;-4.32,-5.09,;-2.99,-5.86,;-1.65,-5.09,;-.32,-5.86,;-.16,-7.39,;1.35,-7.71,;2.12,-6.37,;1.09,-5.23,;3.65,-6.21,;4.28,-4.81,;5.81,-4.64,;6.71,-5.89,;8.24,-5.73,;6.09,-7.3,;4.55,-7.46,;-6.26,-1.6,;-7.77,-1.28,;-8.24,.18,;-7.21,1.32,;-5.71,1,;-4.68,2.15,;-3.17,1.83,;-2.69,.36,;-3.72,-.78,;-5.23,-.46,;-2.14,2.97,;-2.62,4.44,;-1.58,5.58,;-.08,5.26,;.4,3.8,;1.94,3.8,;2.41,5.26,;1.17,6.17,;1.17,7.71,;-.63,2.65,)|
Cc1cn2c(cnc2cc1-c1cnn(c1)C1CCNCC1)-c1ccnc2ccccc12
Cc1cn2c(cnc2cc1-c1cnn(c1)C1CCNCC1)-c1ccc(C(N)=O)c(F)c1
Cc1nn2c(cnc2cc1-c1cnn(c1)[C@H]1CC[C@H](O)CC1)-c1ccnc2nc(ccc12)-c1ccccn1 |r,wU:18.21,wD:15.17,(-.29,-1.34,;-1.2,-2.58,;-2.73,-2.42,;-3.63,-3.67,;-5.17,-3.83,;-5.49,-5.33,;-4.15,-6.1,;-3.01,-5.07,;-1.48,-5.23,;-.57,-3.99,;.96,-4.15,;1.73,-5.48,;3.24,-5.16,;3.4,-3.63,;1.99,-3.01,;4.73,-2.86,;6.07,-3.63,;7.4,-2.86,;7.4,-1.32,;8.73,-.55,;6.07,-.55,;4.73,-1.32,;-6.2,-2.68,;-7.7,-3,;-8.73,-1.86,;-8.26,-.39,;-6.75,-.07,;-6.27,1.39,;-4.77,1.71,;-3.74,.57,;-4.21,-.9,;-5.72,-1.22,;-4.29,3.18,;-5.32,4.32,;-4.85,5.78,;-3.34,6.1,;-2.31,4.96,;-2.79,3.5,)|
Cc1nn2c(cnc2cc1-c1ccc(CN2CCC2)cc1)-c1ccnc2nc(ccc12)-c1ccccn1
CCn1cc(cn1)-c1cc2ncc(-c3ccnc4nc(ccc34)-c3ccccn3)n2nc1C
CC(C)n1cc(cn1)-c1cc2ncc(-c3ccnc4nc(ccc34)-c3ncccn3)n2nc1C
Cc1nn2c(cnc2cc1-c1cnn(c1)[C@H]1CC[C@H](O)CC1)-c1ccnc2nc(ccc12)-c1cnccn1 |r,wU:18.21,wD:15.17,(-.29,-1.34,;-1.2,-2.58,;-2.73,-2.42,;-3.63,-3.67,;-5.17,-3.83,;-5.49,-5.33,;-4.15,-6.1,;-3.01,-5.07,;-1.48,-5.23,;-.57,-3.99,;.96,-4.15,;1.73,-5.48,;3.24,-5.16,;3.4,-3.63,;1.99,-3.01,;4.73,-2.86,;6.07,-3.63,;7.4,-2.86,;7.4,-1.32,;8.73,-.55,;6.07,-.55,;4.73,-1.32,;-6.2,-2.68,;-7.7,-3,;-8.73,-1.86,;-8.26,-.39,;-6.75,-.07,;-6.27,1.39,;-4.77,1.71,;-3.74,.57,;-4.21,-.9,;-5.72,-1.22,;-4.29,3.18,;-5.32,4.32,;-4.85,5.78,;-3.34,6.1,;-2.31,4.96,;-2.79,3.5,)|
Cc1nn2c(cnc2cc1-c1ccc(CN2CCC2)cc1)-c1ccnc2nc(ccc12)-c1cnccn1
CC(C)n1cc(cn1)-c1cc2ncc(-c3ccnc4nc(ccc34)-c3cnccn3)n2nc1C
Cc1nn2c(cnc2cc1-c1cnn(c1)C1CCOCC1)-c1ccnc2nc(ccc12)-c1cnccn1
CC(C)n1cc(cn1)-c1cc2ncc(-c3ccnc4nc(ccc34)-c3ccn(C)n3)n2nc1C
Cc1nn2c(cnc2cc1-c1ccc(CN2CCC2)cc1)-c1ccnc2nc(ccc12)-c1ccn(C)n1
CN(C)C(=O)c1ccc(cc1)-c1cc2ncc(-c3ccnc4nc(ccc34)-c3ccn(C)n3)n2nc1C
Cc1cc(n[nH]1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCC2)cc1
Cc1cc(n[nH]1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCOCC2)cc1
CC(C)n1cc(cn1)-c1cc2ncc(-c3ccnc4nc(ccc34)-c3cc(C)[nH]n3)n2nc1C
CC(C)n1cc(cn1)-c1cc2ncc(-c3ccnc4nc(ccc34)-c3cn(C)cn3)n2nc1C
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCCC2)cc1
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCOCC2)cc1
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN(C)C)cc1
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(-c3cnn(c3)C(C)C)c(C)nn12
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCC2)cc1
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CC(F)(F)C2)cc1
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCO[C@@H](C)C2)cc1 |r|
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCO[C@H](CO)C2)cc1 |r|
Cc1cnn(n1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCCC2)cc1
CC(C)n1cc(cn1)-c1cc2ncc(-c3ccnc4nc(ccc34)-n3ncc(C)n3)n2nc1C
Cc1cnn(n1)-c1ccc2c(ccnc2n1)-c1cnc2cc(-c3cnn(c3)C3CCOCC3)c(C)nn12
CN(C)Cc1ccc(cc1)-c1cc2ncc(-c3ccnc4nc(ccc34)-n3ncc(C)n3)n2nc1C
Cc1cnn(n1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCOCC2)cc1
Cc1cnn(n1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CC[C@](C)(O)C2)cc1 |r|
Cc1cnn(n1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCC(O)CC2)cc1
Cc1cnn(n1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCC(C)(O)CC2)cc1
Cc1cnn(n1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CC(C)(O)C2)cc1
CN1CCN(Cc2ccc(cc2)-c2cc3ncc(-c4ccnc5nc(ccc45)-n4ncc(C)n4)n3nc2C)CC1
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCC(O)CC2)cc1
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CCC(C)(O)CC2)cc1
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(cc1)[C@@]12C[C@@H]1CN(C2)C1CCOCC1 |r|
CCn1cnc(c1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CC3CCC2CC3)cc1 |(-6.36,6.78,;-4.85,6.46,;-4.37,4.99,;-2.91,4.52,;-2.91,2.98,;-4.37,2.5,;-5.28,3.75,;-4.85,1.04,;-3.82,-.11,;-4.3,-1.57,;-5.8,-1.89,;-6.28,-3.36,;-7.78,-3.68,;-8.82,-2.53,;-8.34,-1.07,;-6.83,-.75,;-6.36,.72,;-5.25,-4.5,;-5.57,-6.01,;-4.23,-6.78,;-3.09,-5.75,;-1.56,-5.91,;-.65,-4.66,;-1.28,-3.26,;-.37,-2.01,;-2.81,-3.09,;-3.72,-4.34,;.88,-4.82,;1.5,-6.23,;3.04,-6.39,;3.94,-5.15,;5.47,-5.31,;6.38,-4.06,;7.91,-4.22,;8.82,-2.98,;8.19,-1.57,;6.66,-1.41,;5.75,-2.65,;7.09,-3.42,;7.48,-1.94,;3.32,-3.74,;1.78,-3.58,)|
Cc1cnn(n1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(CN2CC3CCC2CC3)cc1 |(-4.85,6.62,;-4.37,5.15,;-2.91,4.68,;-2.91,3.14,;-4.37,2.66,;-5.28,3.91,;-4.85,1.2,;-3.82,.05,;-4.3,-1.41,;-5.8,-1.73,;-6.28,-3.2,;-7.78,-3.52,;-8.82,-2.37,;-8.34,-.91,;-6.83,-.59,;-6.36,.88,;-5.25,-4.34,;-5.57,-5.85,;-4.23,-6.62,;-3.09,-5.59,;-1.56,-5.75,;-.65,-4.5,;-1.28,-3.1,;-.37,-1.85,;-2.81,-2.93,;-3.72,-4.18,;.88,-4.66,;1.5,-6.07,;3.04,-6.23,;3.94,-4.99,;5.47,-5.15,;6.38,-3.9,;7.91,-4.06,;8.82,-2.82,;8.19,-1.41,;6.66,-1.25,;5.75,-2.49,;7.09,-3.26,;7.48,-1.78,;3.32,-3.58,;1.78,-3.42,)|
Cc1cnn(n1)-c1ccc2c(ccnc2n1)-c1cnc2cc(c(C)nn12)-c1ccc(cc1)[C@@]12C[C@@H]1CN(C2)C1CCOCC1 |r|