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SMILES SMILES_CANONICAL MOLPORTID
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COC1=C(O)C=CC(=C1)C(C)=O COc1cc(ccc1O)C(C)=O Molport-000-000-274
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CC(=O)C1=NC=CC=C1N CC(=O)c1ncccc1N Molport-000-000-275
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C=CCOC1=C(C=O)C=CC=C1 C=CCOc1ccccc1C=O Molport-000-000-277
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OC1=C(C=O)C=CC=C1CC=C Oc1c(CC=C)cccc1C=O Molport-000-000-278
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NC1=NC=C(Br)N=C1 Nc1cnc(Br)cn1 Molport-000-000-280
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Cl.NC1CCCCCC1C(O)=O Cl.NC1CCCCCC1C(O)=O Molport-000-000-281
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NC1CCCCC1C(O)=O NC1CCCCC1C(O)=O Molport-000-000-282
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NC1=C(N=CC=C1)C(O)=O Nc1cccnc1C(O)=O Molport-000-000-285
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NC1CCC2=CC=CC=C2NC1=O NC1CCc2ccccc2NC1=O Molport-000-000-286
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NC1=CC=C2CCCC(=O)NC2=C1 Nc1ccc2CCCC(=O)Nc2c1 Molport-000-000-287
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CC(C)(C)OC(=O)N1CCCC(N)C1 CC(C)(C)OC(=O)N1CCCC(N)C1 Molport-000-000-289
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CC(C)(C)OC(=O)N1CCC(N)CC1 CC(C)(C)OC(=O)N1CCC(N)CC1 Molport-000-000-290
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NC1=CC=CN=C1C#N Nc1cccnc1C#N Molport-000-000-291
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NC1(CCCCCC1)C(O)=O NC1(CCCCCC1)C(O)=O Molport-000-000-293
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NC1(CCCCCCC1)C(O)=O NC1(CCCCCCC1)C(O)=O Molport-000-000-294
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NC1(CCCC1)C(O)=O NC1(CCCC1)C(O)=O Molport-000-000-295
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Cl.N[C@H]1C[C@@H](C(O)=O)C2=CC=CC=C12 Cl.N[C@H]1C[C@@H](C(O)=O)c2ccccc12 Molport-000-000-296
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CN1C=NC2=C(N)C=CC=C12 Cn1cnc2c(N)cccc12 Molport-000-000-297
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Cl.CC(C)(CCN)C(O)=O Cl.CC(C)(CCN)C(O)=O Molport-000-000-298
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N[C@@H]1CCC2=CC=CC=C2NC1=O N[C@@H]1CCc2ccccc2NC1=O Molport-000-000-299
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NC1=CC(=O)CCC1 NC1=CC(=O)CCC1 Molport-000-000-303
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CC1=NC2=C(CCCC2)C(N)=C1 Cc1cc(N)c2CCCCc2n1 Molport-000-000-304
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NC1=C(SC=C1)C(O)=O Nc1ccsc1C(O)=O Molport-000-000-305
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Cl.NC1=C(C=C(C=N1)C(O)=O)C(O)=O Cl.Nc1ncc(cc1C(O)=O)C(O)=O Molport-000-000-306
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Cl.CCOC(=O)CC(N)=N Cl.CCOC(=O)CC(N)=N Molport-000-000-307
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CC1=NSC2=CC=C(N)C=C12 Cc1nsc2ccc(N)cc12 Molport-000-000-308
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NC1=CC=C(C=C1)C1=CC=C(O)C=C1 Nc1ccc(cc1)-c1ccc(O)cc1 Molport-000-000-313
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NC(CO)CC(O)=O NC(CO)CC(O)=O Molport-000-000-314
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CCOC(=O)C1=C(N)ON=C1 CCOC(=O)c1cnoc1N Molport-000-000-315
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CC1=CC=C(C=C1N)S(N)(=O)=O Cc1ccc(cc1N)S(N)(=O)=O Molport-000-000-316
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NC1=C(C=CN=N1)C(O)=O Nc1nnccc1C(O)=O Molport-000-000-317
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NC1N=C(C2=CC=CC=C2)C2=CC=CC=C2NC1=O NC1N=C(c2ccccc2)c2ccccc2NC1=O Molport-000-000-319
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NC1=C(C=C(C#N)C(Cl)=N1)C#N Nc1nc(Cl)c(cc1C#N)C#N Molport-000-000-320
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NC1=C2C=CC(Cl)=CC2=NC=C1 Nc1ccnc2cc(Cl)ccc12 Molport-000-000-321
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NC1=CC=CC(=C1)S(=O)(=O)NCCCBr Nc1cccc(c1)S(=O)(=O)NCCCBr Molport-000-000-322
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Cl.NC1(CCC1)C(O)=O Cl.NC1(CCC1)C(O)=O Molport-000-000-323
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Cl.COC(=O)C1(N)CCC1 Cl.COC(=O)C1(N)CCC1 Molport-000-000-324
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NC1=CC=C(C=C1)C(=O)C(O)=O Nc1ccc(cc1)C(=O)C(O)=O Molport-000-000-326
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NC1CCC(C1)C(O)=O NC1CCC(C1)C(O)=O Molport-000-000-328
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NCCCCCCCCCC(O)=O NCCCCCCCCCC(O)=O Molport-000-000-330
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CC(C)(C)OC(=O)N1CCCCC1CCN CC(C)(C)OC(=O)N1CCCCC1CCN Molport-000-000-331
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NCCC1=CN=CC=C1 NCCc1cccnc1 Molport-000-000-332
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NCCC1=CC=NC=C1 NCCc1ccncc1 Molport-000-000-333
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NC(=O)C1=C(N)N=CN1 NC(=O)c1[nH]cnc1N Molport-000-000-334
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Cl.NC(=N)C1=CC(=CC=C1)C(O)=O Cl.NC(=N)c1cccc(c1)C(O)=O Molport-000-000-335
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Cl.Cl.NCC1=CC=C(C=C1)C(N)=N Cl.Cl.NCc1ccc(cc1)C(N)=N Molport-000-000-336
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Cl.NCC1=CC=CC(=C1)C(O)=O Cl.NCc1cccc(c1)C(O)=O Molport-000-000-337
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CC(C)(C)OC(=O)N1CCCCC1CN CC(C)(C)OC(=O)N1CCCCC1CN Molport-000-000-338
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CC(C)(C)OC(=O)N1CCCC(CN)C1 CC(C)(C)OC(=O)N1CCCC(CN)C1 Molport-000-000-339
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CC(C)(C)OC(=O)N1CCC(CN)CC1 CC(C)(C)OC(=O)N1CCC(CN)CC1 Molport-000-000-340
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CC(C)(C)OC(=O)N1CCCC1CN CC(C)(C)OC(=O)N1CCCC1CN Molport-000-000-341
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NCC1CC1C(O)=O NCC1CC1C(O)=O Molport-000-000-342
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NCCCCCCCCC(O)=O NCCCCCCCCC(O)=O Molport-000-000-344
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NC1C(O)CC2CCCCC12 NC1C(O)CC2CCCCC12 Molport-000-000-345
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CC1=CC=CC(N)=C1O Cc1cccc(N)c1O Molport-000-000-346
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NC1=CC=C(C=C1)S(F)(F)(F)(F)F Nc1ccc(cc1)S(F)(F)(F)(F)F Molport-000-000-347
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NC1=CC=CC(=C1)S(F)(F)(F)(F)F Nc1cccc(c1)S(F)(F)(F)(F)F Molport-000-000-348
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NCCCC1=C(O)C=CC=C1 NCCCc1ccccc1O Molport-000-000-349
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NCCCN1CCNCC1 NCCCN1CCNCC1 Molport-000-000-351
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NC1=NC=CN=C1 Nc1cnccn1 Molport-000-000-352
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NC1=C2C=CC=CC2=NC=C1 Nc1ccnc2ccccc12 Molport-000-000-353
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NC1=NN=NN1 Nc1nnn[nH]1 Molport-000-000-354
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O=CC1=CC=C(N1)C1=CC=CC=C1 O=Cc1ccc([nH]1)-c1ccccc1 Molport-000-000-356
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N[C@H](CO)CC(O)=O N[C@H](CO)CC(O)=O Molport-000-000-357
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CC(C)(C)N=NC(C)(C)C CC(C)(C)N=NC(C)(C)C Molport-000-000-359
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CCOC(OCC)C=C CCOC(OCC)C=C Molport-000-000-360
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Cl.NCC1=NC=CN=C1Cl Cl.NCc1nccnc1Cl Molport-000-000-361
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NCC1=CC=C(CC(O)=O)C=C1 NCc1ccc(CC(O)=O)cc1 Molport-000-000-363
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NC1CCCC2=NC=CC=C12 NC1CCCc2ncccc12 Molport-000-000-364
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COCC(N)COC COCC(N)COC Molport-000-000-366
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CC1=CC=CC(CCN)=N1 Cc1cccc(CCN)n1 Molport-000-000-368
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Cl.Cl.NC1CCCNC1 Cl.Cl.NC1CCCNC1 Molport-000-000-369
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Cl.Cl.N[C@@H]1CCCNC1 Cl.Cl.N[C@@H]1CCCNC1 Molport-000-000-370
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Cl.Cl.N[C@H]1CCCNC1 Cl.Cl.N[C@H]1CCCNC1 Molport-000-000-371
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NC1CCCCCC1CO NC1CCCCCC1CO Molport-000-000-373
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NC1(CO)CCCC1 NC1(CO)CCCC1 Molport-000-000-374
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Cl.Cl.NCCC1CCCNC1 Cl.Cl.NCCC1CCCNC1 Molport-000-000-377
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CC(C)(C)OC(=O)N1CC(N)CC2=CC=CC=C12 CC(C)(C)OC(=O)N1CC(N)Cc2ccccc12 Molport-000-000-378
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CC(C)(C)OC(=O)N1CCCC(CCN)C1 CC(C)(C)OC(=O)N1CCCC(CCN)C1 Molport-000-000-379
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CC(C)(C)OC(=O)N1CCC(CCN)CC1 CC(C)(C)OC(=O)N1CCC(CCN)CC1 Molport-000-000-380
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NC1=C(C=C(C=N1)C#N)C#N Nc1ncc(cc1C#N)C#N Molport-000-000-381
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Cl.NC1=NC2=CC=C(O)C=C2S1 Cl.Nc1nc2ccc(O)cc2s1 Molport-000-000-384
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NC1=CC(I)=CN=C1Cl Nc1cc(I)cnc1Cl Molport-000-000-385
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NC1(CCNCC1)C(O)=O NC1(CCNCC1)C(O)=O Molport-000-000-386
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NCC1=CC=C2CCCC2=C1 NCc1ccc2CCCc2c1 Molport-000-000-387
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CC1=CC=CN=C1CN Cc1cccnc1CN Molport-000-000-388
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Cl.Cl.CC1=C(CN)C=CN=C1 Cl.Cl.Cc1cnccc1CN Molport-000-000-389
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NCC1=CC2=CC=CN=C2C=C1 NCc1ccc2ncccc2c1 Molport-000-000-390
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CC(C)(C)OC(=O)N1CCC(C1)C(N)=O CC(C)(C)OC(=O)N1CCC(C1)C(N)=O Molport-000-000-392
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CC(C)(C)OC(=O)N1CCC(C1)C(N)=S CC(C)(C)OC(=O)N1CCC(C1)C(N)=S Molport-000-000-393
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Cl.NCC1CCN(CC2=CC=CC=C2)CC1 Cl.NCC1CCN(Cc2ccccc2)CC1 Molport-000-000-394
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Cl.Cl.NC1[C@@H]2CNC[C@H]12 Cl.Cl.NC1[C@@H]2CNC[C@H]12 Molport-000-000-395
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CC(C)(C)OC(=O)N1CCC(CN)C1 CC(C)(C)OC(=O)N1CCC(CN)C1 Molport-000-000-396
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NC1=CC=C(C=C1)C1=NC=NC=C1 Nc1ccc(cc1)-c1ccncn1 Molport-000-000-397
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NC1=C(CNCC1)C#N NC1=C(CNCC1)C#N Molport-000-000-398
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CC(C)(C)OC(=O)NC1CCCCC1N CC(C)(C)OC(=O)NC1CCCCC1N Molport-000-000-399
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OC1CCCNCC1 OC1CCCNCC1 Molport-000-000-403
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Cl.CC(N)=N Cl.CC(N)=N Molport-000-000-404
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NC(C(O)=O)C1=CC=C2OCCOC2=C1 NC(C(O)=O)c1ccc2OCCOc2c1 Molport-000-000-405
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