Added 25 molecules from epoch 20510 for Q63380
Browse files- Q63380_molecules.csv +25 -0
Q63380_molecules.csv
CHANGED
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@@ -8379,3 +8379,28 @@ rxn:1:65526:17123,COc1cc(-c2cn(CC3CC(=O)N(c4nccc(-c5ccco5)n4)C3)nn2)ccc1-n1nc(O)
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| 8379 |
rxn:1:65673:1693,COc1nc(-c2cn(CC=Cc3ccsc3C)nn2)ncc1F,LTJIQXWNUCHQKG-UHFFFAOYSA-N
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| 8380 |
rxn:1:65673:38711,Cc1sccc1C=CCn1cc(-c2ncccc2N)nn1,KIGDZCIMRNXEEU-UHFFFAOYSA-N
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| 8381 |
rxn:1:65729:2983,Cc1n[nH]c(C)c1C=CCn1cc(Cc2ccc(Br)s2)nn1,REALJJGMSLPKAU-UHFFFAOYSA-N
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| 8379 |
rxn:1:65673:1693,COc1nc(-c2cn(CC=Cc3ccsc3C)nn2)ncc1F,LTJIQXWNUCHQKG-UHFFFAOYSA-N
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| 8380 |
rxn:1:65673:38711,Cc1sccc1C=CCn1cc(-c2ncccc2N)nn1,KIGDZCIMRNXEEU-UHFFFAOYSA-N
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| 8381 |
rxn:1:65729:2983,Cc1n[nH]c(C)c1C=CCn1cc(Cc2ccc(Br)s2)nn1,REALJJGMSLPKAU-UHFFFAOYSA-N
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| 8382 |
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rxn:1:40930:1062,CC(C)(CN)Cn1cc(-c2ccc(Cl)c(Br)c2)nn1,JKMNKOZWCOQNBA-UHFFFAOYSA-N
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| 8383 |
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rxn:1:41718:38722,Nc1cncc(-c2cn(-c3cc(Br)ccc3I)nn2)c1,WVSLKLSHKGNMEX-UHFFFAOYSA-N
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| 8384 |
+
rxn:1:41745:3659,CC1(c2cn(-c3ccc(Cl)c(Br)c3)nn2)CCNC1,FSOHCDNNRXDPDU-UHFFFAOYSA-N
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| 8385 |
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rxn:1:41921:8808,Cc1cscc1C#CCn1cc(-c2ccc(CN)cc2)nn1,ARJUMQIYTOVLQG-UHFFFAOYSA-N
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| 8386 |
+
rxn:1:42312:23539,Nc1c(-c2cn(CC#Cc3ccc(Cl)nc3Cl)nn2)oc2nccnc12,RTQBVVMVUJZJGT-UHFFFAOYSA-N
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| 8387 |
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rxn:1:42845:1060,Nc1ncnc2[nH]nc(C#CCn3cc(-c4cc(Br)cs4)nn3)c12,IGYREKVUYWLNPI-UHFFFAOYSA-N
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| 8388 |
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rxn:1:49432:1750,Clc1cccc(SCc2cn(C3(CI)CCNC3)nn2)c1Cl,ZSUDQXBXPCESBC-UHFFFAOYSA-N
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| 8389 |
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rxn:1:55320:2089,Cc1csc(-c2cn(CC3CC3c3cc(Br)cnc3N)nn2)c1,FQBISZLQQNLGRD-UHFFFAOYSA-N
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| 8390 |
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rxn:1:55472:1853,Nc1ncc(-c2cn(CC3CC3c3ccc(O)c(Cl)n3)nn2)cc1Br,WGICVVLZDHHQIQ-UHFFFAOYSA-N
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| 8391 |
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rxn:1:55948:27945,SCC=Cc1cccc(-c2cn(CCI)nn2)c1,BVCGZTQGXMRWOD-UHFFFAOYSA-N
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| 8392 |
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rxn:1:57017:31438,N#Cc1cnc(N)c(-c2cn(CCCc3sccc3Br)nn2)c1,KQQQPEKDQZKSAQ-UHFFFAOYSA-N
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| 8393 |
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rxn:1:57043:32047,NCc1ccc(-c2cn(CCCc3csc(Br)n3)nn2)cc1O,QPUXTFKRSXIOFW-UHFFFAOYSA-N
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| 8394 |
+
rxn:1:57939:8557,COc1nc(CCCn2cc(-c3csc(Br)c3)nn2)cnc1N,JZPBYUFQMPHUFW-UHFFFAOYSA-N
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| 8395 |
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rxn:1:58069:1429,Cc1sc(-c2cn(CCCc3n[nH]c4ncnc(N)c34)nn2)cc1Br,MQOXAWMQXFFGBJ-UHFFFAOYSA-N
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| 8396 |
+
rxn:1:58649:1369,O=c1cnc(-c2cn(-c3cccc(CCCBr)c3)nn2)c[nH]1,FTXGOGXCZQXSBA-UHFFFAOYSA-N
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| 8397 |
+
rxn:1:59279:1595,Nc1cc(Cl)cc(CCCCn2cc(-c3csc(Br)n3)nn2)c1O,KKYLLSQPYHWYPL-UHFFFAOYSA-N
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| 8398 |
+
rxn:1:59325:35342,Clc1ccc(-c2cn(CCCCc3cnc4nc[nH]c4c3)nn2)s1,QIMRUAHXBBQDRZ-UHFFFAOYSA-N
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| 8399 |
+
rxn:1:59915:31895,COc1cc(C)c(-c2cn(Cc3sc(Br)cc3Br)nn2)cn1,YUBDFLMDEGKPCJ-UHFFFAOYSA-N
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| 8400 |
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rxn:1:61827:39706,CC(CO)(CO)Cc1cn(-c2ccc(I)c(Br)c2)nn1,MSRRUEPARLUCKB-UHFFFAOYSA-N
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| 8401 |
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rxn:1:62588:3915,Oc1ncc(-c2cn(C3CCCC3I)nn2)cc1F,HHVSXNOUGHORFT-UHFFFAOYSA-N
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| 8402 |
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rxn:1:62688:12256,NCC1(c2cn(-c3cc(I)cc(I)c3I)nn2)CCCC1,BQHNIEWLABEJGJ-UHFFFAOYSA-N
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| 8403 |
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rxn:1:62688:18918,NCCCCc1cn(-c2cc(I)cc(I)c2I)nn1,JBKFLIZMIORHAY-UHFFFAOYSA-N
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| 8404 |
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rxn:1:64029:31372,CNCCc1ccc(-c2cn(Cc3cscn3)nn2)cc1Cl,PPGQVKDCNOBGNU-UHFFFAOYSA-N
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| 8405 |
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rxn:1:65678:39067,Cc1cc(-c2cn(CC=Cc3ccsc3Cl)nn2)cc(C)n1,CQVFENQQBABZDK-UHFFFAOYSA-N
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| 8406 |
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rxn:3:51425:19661:105750,Cc1cc(-c2cn(CC3C(c4cc(C(F)(F)F)ccc4C(=O)Nc4cc(C56CC7CC(CC(C7)C5)C6)ccc4C)C3(F)F)nn2)n(Cc2ccccc2)n1,QDBKRCMCGLXQQC-UHFFFAOYSA-N
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