Compound Name

SMILES String

Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1

c1ccc(cc1)C(c2ccccc2)(c3ccccc3Cl)n4ccnc4

c1cc(c(cc1Cl)Cl)CO[C@@H](Cn2ccnc2)c3ccc(cc3Cl)Cl

CC(=O)N1CCN(CC1)c2ccc(cc2)OC[C@H]3CO[C@](O3)(Cn4ccnc4)c5ccc(cc5Cl)Cl

c1cc(c(cc1F)F)C(Cn2cncn2)(Cn3cncn3)O

CCC(C)n1ncn(-c2ccc(cc2)N2CCN(CC2)c2ccc(OC[C@H]3CO[C@@](Cn4cncn4)(O3)c3ccc(Cl)cc3Cl)cc2)c1=O |r|

c1nc(c[nH]1)-c1ccccc1

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

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |t:14|

c1cc(ccc1N)Sc2ccc(cc2)N3C(=O)c4ccc(cc4C3=O)N

c1ccc(cc1)N

c1ccc(cc1)CN

CC1CCC(CC1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccncc1 |wD:10.10,(-12.38,-2.68,;-10.84,-2.68,;-10.07,-1.35,;-8.53,-1.35,;-7.76,-2.68,;-8.53,-4.01,;-10.07,-4.01,;-6.22,-2.68,;-5.45,-4.01,;-5.45,-1.35,;-3.91,-1.35,;-3.14,-.01,;-1.6,-.01,;-.69,-1.26,;.77,-.78,;.77,.76,;1.92,1.79,;1.6,3.3,;.13,3.77,;-1.01,2.74,;-.69,1.23,;-3.14,-2.68,;-3.91,-4.01,;-1.6,-2.68,;-.83,-4.01,;.71,-4.01,;1.48,-5.35,;.71,-6.68,;-.83,-6.68,;-1.6,-5.35,)|

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)=C |r,t:9|

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)=CC |r,t:9|