text
stringlengths
23
3.07k
COC(=O)C(=O)CC(=O)C1=CC=C2N(C)C(=O)N(C)C2=C1 COC(=O)C(=O)CC(=O)c1ccc2n(C)c(=O)n(C)c2c1 Molport-051-815-163
CC1=CC=CN2C(=O)C(C=O)=C(N=C12)N1CCCC2=C1C=CC=C2 Cc1cccn2c1nc(N1CCCc3ccccc13)c(C=O)c2=O Molport-051-815-164
CC1=CC=CN2C(=O)C(C=O)=C(N=C12)N(CC=C)CC1=CC=C(Cl)C=C1 Cc1cccn2c1nc(N(CC=C)Cc1ccc(Cl)cc1)c(C=O)c2=O Molport-051-815-165
CC(N1N=CC2=C1C(C)=NN2C)C(O)=O CC(C(O)=O)n1ncc2n(C)nc(C)c12 Molport-051-815-166
COC(=O)C1=C(NN=N1)OC1=CC=C(C=C1)C(C)(C)C COC(=O)c1nn[nH]c1Oc1ccc(cc1)C(C)(C)C Molport-051-815-167
COC(=O)C1=CC=C(CN2N=NC3=C(N(C)N=C3C)C2=O)O1 COC(=O)c1ccc(Cn2nnc3c(C)nn(C)c3c2=O)o1 Molport-051-815-168
COC(=O)CN1N=CC2=C1C(C)=NN2C COC(=O)Cn1ncc2n(C)nc(C)c12 Molport-051-815-169
CC1=NN(CC2=CC=CC=C2)C2=CN(CC(O)=O)N=C12 Cc1nn(Cc2ccccc2)c2cn(CC(O)=O)nc12 Molport-051-815-170
CC1=NN(CC2=CC=CC=C2)C2=C1N(CC(O)=O)N=C2 Cc1nn(Cc2ccccc2)c2cnn(CC(O)=O)c12 Molport-051-815-171
CN1N=C(C)C2=NN(CC3=CC=C(C=C3)C(O)=O)C=C12 Cc1nn(C)c2cn(Cc3ccc(cc3)C(O)=O)nc12 Molport-051-815-172
CCN1N=C(C)C2=C1C=NN2CC(=O)OC CCn1nc(C)c2n(CC(=O)OC)ncc12 Molport-051-815-173
CN1N=C(C)C2=NN(CC3=CC=C(O3)C(O)=O)C=C12 Cc1nn(C)c2cn(Cc3ccc(o3)C(O)=O)nc12 Molport-051-815-174
ClC1=CC=C(C=C1)C1=NC(N2CCNCC2)=C2OC(=NC2=N1)C1=CC=CC=C1 Clc1ccc(cc1)-c1nc(N2CCNCC2)c2oc(nc2n1)-c1ccccc1 Molport-051-815-291
Cl.NCC1=CC=C(OC2CC2)C=C1 Cl.NCc1ccc(OC2CC2)cc1 Molport-051-815-586
C[Si](C)(C)C#CC(O)CCC1=CC=CC=C1 C[Si](C)(C)C#CC(O)CCc1ccccc1 Molport-051-815-587
CN(C)C1=C2SC=CC2=NC(Cl)=N1 CN(C)c1nc(Cl)nc2ccsc12 Molport-051-815-588
COC[C@@H]1CNC[C@H]1C(F)F COC[C@@H]1CNC[C@H]1C(F)F Molport-051-815-589
Cl.COC(=O)CC1CC2CNCC12 Cl.COC(=O)CC1CC2CNCC12 Molport-051-815-590
Cl.BrC1=CC=C2C3CCC(N3)C2=C1 Cl.Brc1ccc2C3CCC(N3)c2c1 Molport-051-815-592
CC(C)(C)OC(=O)N1C2CCC1C1=CC(Br)=CC=C21 CC(C)(C)OC(=O)N1C2CCC1c1cc(Br)ccc21 Molport-051-815-594
Cl.COC(=O)C1=CC2=C(C=C1)C1CCC2N1 Cl.COC(=O)c1ccc2C3CCC(N3)c2c1 Molport-051-815-595
CC(C)(C)OC(=O)N1C2CCC1C1=CC(=CC=C21)C(O)=O CC(C)(C)OC(=O)N1C2CCC1c1cc(ccc21)C(O)=O Molport-051-815-597
Cl.ClCC(=O)C1CCNC1 Cl.ClCC(=O)C1CCNC1 Molport-051-815-598
Cl.Cl.C1C2CNCC2C1C1=NC=CC=C1 Cl.Cl.C1C2CNCC2C1c1ccccn1 Molport-051-815-600
CC1(C)OB(OC1(C)C)C1=CC=C2C3CCC(O3)C2=C1 CC1(C)OB(OC1(C)C)c1ccc2C3CCC(O3)c2c1 Molport-051-815-602
CN1CCN2N=CC(C=O)=C2C1 CN1CCn2ncc(C=O)c2C1 Molport-051-815-603
FC1=CC=C2N=C(C=O)C=C(I)C2=C1 Fc1ccc2nc(C=O)cc(I)c2c1 Molport-051-815-604
CC1=C(Br)C=C(C=N1)S(F)(=O)=O Cc1ncc(cc1Br)S(F)(=O)=O Molport-051-815-605
OC(=O)C1=CC2=CC=CC=C2C(=O)N1C1CC1 OC(=O)c1cc2ccccc2c(=O)n1C1CC1 Molport-051-815-606
Cl.NCC(C(F)F)C1CCC1 Cl.NCC(C(F)F)C1CCC1 Molport-051-815-635
Cl.NC12CCC(CC1)(CC2)C#C Cl.NC12CCC(CC1)(CC2)C#C Molport-051-815-649
FC(F)(F)C1=CC(=CC(C=O)=C1)N1CCOCC1 FC(F)(F)c1cc(C=O)cc(c1)N1CCOCC1 Molport-051-815-761
CNC1=CC(=CC(=C1)C1CC1)C(F)(F)F CNc1cc(cc(c1)C(F)(F)F)C1CC1 Molport-051-815-774
Cl.Cl.NC1CCN2C=CN=C12 Cl.Cl.NC1CCn2ccnc12 Molport-051-815-784
OC(=O)C1=CC2=CC(Br)=CN=C2N=C1C(F)(F)F OC(=O)c1cc2cc(Br)cnc2nc1C(F)(F)F Molport-051-815-787
FC(F)(F)C1=CC(=CC(=C1)C#N)C1CC1 FC(F)(F)c1cc(cc(c1)C1CC1)C#N Molport-051-815-827
OC(=O)C1=CC(=CC(=C1)C1CC1)C1CC1 OC(=O)c1cc(cc(c1)C1CC1)C1CC1 Molport-051-815-913
FC(F)(F)C1=C(C=CC(C=O)=C1)C1CC1 FC(F)(F)c1cc(C=O)ccc1C1CC1 Molport-051-815-950
FC1=CC(=CN=C1F)C1CC1 Fc1cc(cnc1F)C1CC1 Molport-051-815-954
FC1=NC=C(C=C1Cl)C1CC1 Fc1ncc(cc1Cl)C1CC1 Molport-051-815-956
NC1=C(F)C=C(C=C)C=C1 Nc1ccc(C=C)cc1F Molport-051-816-060
FC(F)[C@H]1CC[C@H](CBr)CC1 FC(F)[C@H]1CC[C@H](CBr)CC1 Molport-051-816-244
NC1=CC=CC(=N1)C1=CNN=C1 Nc1cccc(n1)-c1cn[nH]c1 Molport-051-816-330
OB(O)C1=CC(=CC(F)=C1)C(F)F OB(O)c1cc(F)cc(c1)C(F)F Molport-051-816-362
Cl.O=C1NC(=O)C2(CNC2)O1 Cl.O=C1NC(=O)C2(CNC2)O1 Molport-051-816-417
Cl.NC1=NCCCC1C(F)(F)F Cl.NC1=NCCCC1C(F)(F)F Molport-051-816-419
CN1C[C@@H](C(F)F)[C@@H](C1)C(O)=O CN1C[C@@H](C(F)F)[C@@H](C1)C(O)=O Molport-051-816-425
Cl.Cl.NC1=CC=C2SC=NC2=C1O Cl.Cl.Nc1ccc2scnc2c1O Molport-051-816-430
NC1=NC=C(CC(F)(F)F)S1 Nc1ncc(CC(F)(F)F)s1 Molport-051-816-529
Cl.NC12CC(C1)(OC2)C(F)F Cl.NC12CC(C1)(OC2)C(F)F Molport-051-816-616
FC1(F)OC(F)(F)C2=C1C=CC(Br)=C2 FC1(F)OC(F)(F)c2cc(Br)ccc12 Molport-051-816-635
Cl.COC(=O)C1=CC=CC=C1C1=NC=CC=C1 Cl.COC(=O)c1ccccc1-c1ccccn1 Molport-051-816-666
Cl.C#CCCC=C1CCNCC1 Cl.C#CCCC=C1CCNCC1 Molport-051-816-668
COC(=O)C(\Br)=C\C1=CNC2=CC=CC=C12 COC(=O)C(\Br)=C\c1c[nH]c2ccccc12 Molport-051-816-669
Cl.COCC1C(COC)C2CNCC12 Cl.COCC1C(COC)C2CNCC12 Molport-051-816-671
Cl.FC1CNCCC11N=N1 Cl.FC1CNCCC11N=N1 Molport-051-816-673
CC(C)(C)OC(=O)N1CC2CC(F)(CO)C2C1 CC(C)(C)OC(=O)N1CC2CC(F)(CO)C2C1 Molport-051-816-675
Cl.OCC1(F)CC2CNCC12 Cl.OCC1(F)CC2CNCC12 Molport-051-816-676
OC(=O)C12CC3CC(C1)C1(N=N1)C(C3)C2 OC(=O)C12CC3CC(C1)C1(N=N1)C(C3)C2 Molport-051-816-678
OC(=O)C1=CC2=CC=CC=C2C(=O)N1C1=C(F)C=C(F)C=C1 OC(=O)c1cc2ccccc2c(=O)n1-c1ccc(F)cc1F Molport-051-816-679
OC(=O)C1=CC2=CC=CC=C2C(=O)N1C1=CC=C(F)C=C1 OC(=O)c1cc2ccccc2c(=O)n1-c1ccc(F)cc1 Molport-051-816-680
CCN1C(=O)C2=CC(F)=C(F)C=C2C=C1C(O)=O CCn1c(cc2cc(F)c(F)cc2c1=O)C(O)=O Molport-051-816-681
OC(=O)C1=CC2=CC(F)=C(F)C=C2C(=O)N1C1=CC=C(F)C=C1 OC(=O)c1cc2cc(F)c(F)cc2c(=O)n1-c1ccc(F)cc1 Molport-051-816-682
OC(=O)C1=CC2=CC(F)=C(F)C=C2C(=O)N1C1CC1 OC(=O)c1cc2cc(F)c(F)cc2c(=O)n1C1CC1 Molport-051-816-683
FC(F)(F)C1=CC(=CC(=C1)N=[N+]=[N-])N=[N+]=[N-] FC(F)(F)c1cc(cc(c1)N=[N+]=[N-])N=[N+]=[N-] Molport-051-816-684
OC(=O)C1=CC2=CC(F)=C(F)C=C2C(=O)N1C1=C(F)C=C(F)C=C1 OC(=O)c1cc2cc(F)c(F)cc2c(=O)n1-c1ccc(F)cc1F Molport-051-816-685
NC1=CC(=CC(=C1)N=[N+]=[N-])C(F)(F)F Nc1cc(cc(c1)C(F)(F)F)N=[N+]=[N-] Molport-051-816-686
Cl.Cl.CN1CCN(CC1)C(=O)C1CNC1 Cl.Cl.CN1CCN(CC1)C(=O)C1CNC1 Molport-051-816-687
[Br-].CCCCN1C=C[N+](CCCC)=C1 [Br-].CCCCn1cc[n+](CCCC)c1 Molport-051-818-202
ClC(=O)CCCI ClC(=O)CCCI Molport-051-818-278
COC1=CC2=C(C=CC=C2N=C1)B1OC(C)(C)C(C)(C)O1 COc1cnc2cccc(B3OC(C)(C)C(C)(C)O3)c2c1 Molport-051-818-283
COC1=CC2=C(O)C=CC=C2N=C1 COc1cnc2cccc(O)c2c1 Molport-051-818-284
COC(=O)C1=CC2=NC=CN2C=C1Br COC(=O)c1cc2nccn2cc1Br Molport-051-818-289
COC1=C(N)C=C2C=CNC(=O)C2=C1 COc1cc2c(cc[nH]c2=O)cc1N Molport-051-818-290
OB(O)C1=CC=C(OC2=CC=C(OC(F)(F)F)C=C2)N=C1 OB(O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)nc1 Molport-051-818-292
BrC1=CC(=NC(=C1)C1=NC2=CC=CC=C2N1)C1=NC2=CC=CC=C2N1 Brc1cc(nc(c1)-c1nc2ccccc2[nH]1)-c1nc2ccccc2[nH]1 Molport-051-818-294
NC1=C(C=CC=C1)C1=CC2=CC=CC=C2S1 Nc1ccccc1-c1cc2ccccc2s1 Molport-051-818-318
CC1=CC=C(C=C1)C1=C(N)C(C)=CC=C1 Cc1ccc(cc1)-c1cccc(C)c1N Molport-051-818-343
Cl.O=C1CCNCCO1 Cl.O=C1CCNCCO1 Molport-051-818-466
CC(C)(C1=CC=C(CC(O)=O)C=C1)C(F)(F)F CC(C)(c1ccc(CC(O)=O)cc1)C(F)(F)F Molport-051-818-467
COC1=C(C=CC=C1N)C(C)(C)C COc1c(N)cccc1C(C)(C)C Molport-051-818-468
COC1=C(C=CC=C1C(C)(C)C)[N+]([O-])=O COc1c(cccc1C(C)(C)C)[N+]([O-])=O Molport-051-818-469
CCOC1=CC=CN=C1OC1=CN=CC(=C1)C1=NC=C(C=N1)C(=O)N[C@@H]1CNC[C@@H](F)C1 CCOc1cccnc1Oc1cncc(c1)-c1ncc(cn1)C(=O)N[C@@H]1CNC[C@@H](F)C1 Molport-051-818-471
OC1=CC=C(Cl)C(Br)=C1O Oc1ccc(Cl)c(Br)c1O Molport-051-818-472
CCOC1=CC=C(C[C@@H](CO)NC(=O)OC(C)(C)C)C=C1 CCOc1ccc(C[C@@H](CO)NC(=O)OC(C)(C)C)cc1 Molport-051-818-473
OC(=O)\C=C\C(O)=O.COC1=CC=C2C(NC3=C2CCN(C)CC3)=C1 OC(=O)\C=C\C(O)=O.COc1ccc2c3CCN(C)CCc3[nH]c2c1 Molport-051-818-474
FC(F)OC1=CC=C2C(=O)NC=CC2=C1 FC(F)Oc1ccc2c(cc[nH]c2=O)c1 Molport-051-818-475
CC1=NN=C2C=C(C=CN12)B1OC(C)(C)C(C)(C)O1 Cc1nnc2cc(ccn12)B1OC(C)(C)C(C)(C)O1 Molport-051-818-476
OC(=O)C(F)(F)F.CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O OC(=O)C(F)(F)F.CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O Molport-051-818-477
Cl.N[C@@H](CC1=C2C=CC=CC2=CC2=CC=CC=C12)C(O)=O Cl.N[C@@H](Cc1c2ccccc2cc2ccccc12)C(O)=O Molport-051-818-478
CC(=O)OCOCCOCOC(C)=O CC(=O)OCOCCOCOC(C)=O Molport-051-818-479
CC1=C2NC=C(I)C2=NC=C1Br Cc1c(Br)cnc2c(I)c[nH]c12 Molport-051-818-481
COC(=O)C1=CC=C2C=NNC2=C1C(F)(F)F COC(=O)c1ccc2cn[nH]c2c1C(F)(F)F Molport-051-818-482
CC(C)\C=C\B(O)O CC(C)\C=C\B(O)O Molport-051-818-483
CCCCCCCCC(CCCCCC)C=O CCCCCCCCC(CCCCCC)C=O Molport-051-818-484
[O-][N+](=O)C1=C(Br)C=CC(Cl)=C1C=O [O-][N+](=O)c1c(Br)ccc(Cl)c1C=O Molport-051-818-485
COC1=CC(=O)C2=C(C(C)=C(CO)N2C)C1=O COC1=CC(=O)c2c(c(C)c(CO)n2C)C1=O Molport-051-818-486
OC(=O)C1=CC(C(O)=O)=C(C(O)=O)C(=C1)C(O)=O OC(=O)c1cc(C(O)=O)c(C(O)=O)c(c1)C(O)=O Molport-051-818-487
COC(=O)C1=C(C=C2NC=NC2=C1)[N+]([O-])=O COC(=O)c1cc2nc[nH]c2cc1[N+]([O-])=O Molport-051-818-488
COC1=C(O)C(O)=C2C(=O)C=C(OC2=C1)C1=CC=C(O)C=C1 COc1cc2oc(cc(=O)c2c(O)c1O)-c1ccc(O)cc1 Molport-051-818-489