Compound Name

SMILES String

Brc1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc1

Brc1ccc(NC(=O)NCCc2c[nH]c3ccccc23)cc1

Brc1cccc(NC(=O)NCCc2c[nH]c3ccccc23)c1

CC(=O)N1CCN(CC1)C(=O)Nc1ccccc1

CC(=O)c1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc1

CC(C)CNC(=O)N1CCN(CC1)c1cccc2[nH]ccc12

CC(C)N1CCN(CC1)C(=O)Nc1ccccc1

CC(C)NC(=O)N1CCN(CC1)c1cccc2[nH]ccc12

CCN1CCN(CC1)C(=O)Nc1ccccc1

CN1CCN(CC1)C(=O)Nc1ccccc1

CNC(=O)N1CCN(CC1)c1cccc2[nH]ccc12

CNC(=O)c1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc1

CNC(=O)c1cccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1

COc1c(C)cccc1NC(=O)N1CCN(CC1)c1cccc2[nH]ccc12

COc1cc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc(OC)c1

COc1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c(OC)c1

COc1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc1

COc1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc1OC

COc1ccc(OC)c(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1

COc1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccccc1

COc1ccc(cc1C12CC3CC(CC(C3)C1)C2)-c1ccc2cc(ccc2c1)C(O)=O |TLB:7:8:11:15.14.13,THB:9:10:13:17.8.16,9:8:11.10.15:13,16:8:11:15.14.13,16:14:11:17.9.8|

COc1cccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1

COc1cccc(OC)c1NC(=O)N1CCN(CC1)c1cccc2[nH]ccc12

COc1cccc(c1)N1CCN(CC1)C(=O)Nc1ccccc1

COc1ccccc1N1CCN(CC1)C(=O)Nc1ccccc1

COc1ccccc1NC(=O)N1CCN(CC1)c1cccc2[nH]ccc12

CS(=O)(=O)N1CCN(CC1)C(=O)Nc1ccccc1

Cc1cc(C)cc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1

Cc1cc(N2CCN(CC2)C(=O)Nc2ccccc2)c2cc[nH]c2c1

Cc1ccc(C)c(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1

Cc1ccc(N2CCN(CC2)C(=O)Nc2ccccc2)c2cc[nH]c12

Cc1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c(C)c1

Cc1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc1

Cc1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc1C

Cc1ccc2[nH]ccc2c1N1CCN(CC1)C(=O)Nc1ccccc1

Cc1cccc(C)c1NC(=O)N1CCN(CC1)c1cccc2[nH]ccc12

Cc1cccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1

Cc1cccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1C

Cc1ccccc1NC(=O)N1CCN(CC1)c1cccc2[nH]ccc12

Cc1ccccc1Oc1cc(-n2c(=O)cc([nH]c2=O)C(F)(F)F)c2ccccc2c1Cl |(20.53,-12.27,;19.26,-11.42,;19.36,-9.88,;18.08,-9.03,;16.7,-9.71,;16.59,-11.25,;17.87,-12.1,;17.76,-13.64,;16.38,-14.32,;15.11,-13.47,;13.73,-14.15,;12.45,-13.3,;12.56,-11.76,;13.94,-11.08,;11.28,-10.9,;9.9,-11.59,;9.79,-13.13,;11.07,-13.98,;10.96,-15.52,;8.45,-11.09,;8.55,-9.56,;7.17,-10.24,;7.29,-12.11,;13.62,-15.7,;12.24,-16.38,;12.13,-17.91,;13.41,-18.77,;14.79,-18.09,;14.9,-16.55,;16.28,-15.87,;17.55,-16.72,)|

Clc1cc(Cl)cc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1

Clc1cc(N2CCN(CC2)C(=O)Nc2ccccc2)c2cc[nH]c2c1

Clc1cc2NC(=O)Cc2cc1CCN1CCN(CC1)c1nsc2ccccc12

Clc1ccc(CNC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc1

Clc1ccc(Cl)c(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1

Clc1ccc(N2CCN(CC2)C(=O)Nc2ccccc2)c2cc[nH]c12

Clc1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c(Cl)c1

Clc1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc1

Clc1ccc(NC(=O)N2CCN(CC2)c2ccncc2)cc1

Clc1ccc(NC(=O)NCCc2c[nH]c3ccccc23)c(Cl)c1

Clc1ccc(NC(=O)NCCc2c[nH]c3ccccc23)cc1

Clc1ccc(NC(=O)NCCc2c[nH]c3ccccc23)cc1Cl

Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1cccc2[nH]ccc12

Clc1cccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1

Clc1cccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1Cl

Clc1ccccc1NC(=O)N1CCN(CC1)c1cccc2[nH]ccc12

FC(F)(F)Oc1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc1

FC(F)(F)Oc1ccc(NC(=O)NCCc2c[nH]c3ccccc23)cc1

FC(F)(F)c1ccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)cc1

FC(F)(F)c1ccc(NC(=O)N2CCN(CC2)c2ccncc2)cc1

FC(F)(F)c1ccc(NC(=O)NCCc2c[nH]c3ccccc23)cc1

FC(F)(F)c1cccc(NC(=O)N2CCN(CC2)c2cccc3[nH]ccc23)c1

FC(F)(F)c1cccc(NC(=O)N2CCN(CC2)c2ccncc2)c1

FC(F)(F)c1cccc(NC(=O)NCCc2c[nH]c3ccccc23)c1

FC(F)(F)c1ccccc1NC(=O)N1CCN(CC1)c1cccc2[nH]ccc12

NC1Cc2ccccc2N(O)C1=O

NNc1cccnn1

NNc1nnc(Cl)c2ccccc12

NNc1nnc(NN)c2ccccc12

NNc1nncc2ccccc12

Nc1cccc2cnncc12

Nc1cccnn1

O=C(CCC(=O)Nc1ccccc1)Nc1c[nH]c2ccccc12

O=C(CCc1ccccc1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Cc1ccccc1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(N1CCN(CC1)c1cccc2[nH]ccc12)c1ccccc1

O=C(NCCc1c[nH]c2ccccc12)Nc1ccccc1

O=C(NCCc1c[nH]c2ccccc12)Nc1ccccc1-c1ccccc1

O=C(NCc1ccccc1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1ccc(Cc2ccccc2)cc1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1ccc(cc1)C#N)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1ccc(cc1)C(=O)c1ccccc1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1ccc2ncccc2c1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1ccc2scnc2c1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1cccc(Oc2ccccc2)c1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1cccc(c1)C#N)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1cccc2cccnc12)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1cccc2ncsc12)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1ccccc1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1ccccc1)N1CCN(CC1)c1cccc2[nH]ncc12

O=C(Nc1ccccc1)N1CCN(CC1)c1cccc2cnccc12

O=C(Nc1ccccc1)N1CCN(CC1)c1cccc2ncccc12

O=C(Nc1ccccc1)N1CCN(CC1)c1ccccc1

O=C(Nc1ccccc1)N1CCN(CC1)c1ccncc1

O=C(Nc1ccccc1)N1CCN(Cc2cncs2)CC1

O=C(Nc1ccccc1C#N)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1ccccn1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1cccnc1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1ccncc1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1ccncn1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1ccnnc1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(Nc1cncnc1)N1CCN(CC1)c1cccc2[nH]ccc12

O=C(OCc1ccccc1)N1CCN(CC1)c1cccc2[nH]ccc12

[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(\[#6]=[#6]-2/[#8]-[#6](=O)-[#6](=[#6]-2-[#8])-c2cc(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2-[#8])ccc1-[#8] |c:13|

[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(\[#6]=[#6]-2/[#8]-[#6](=O)-[#6](=[#6]-2-[#8])-c2ccc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c2)ccc1-[#8] |c:13|