Added 30 molecules from epoch 20511 for Q63380
Browse files- Q63380_molecules.csv +30 -0
Q63380_molecules.csv
CHANGED
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@@ -8404,3 +8404,33 @@ rxn:1:62688:18918,NCCCCc1cn(-c2cc(I)cc(I)c2I)nn1,JBKFLIZMIORHAY-UHFFFAOYSA-N
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| 8404 |
rxn:1:64029:31372,CNCCc1ccc(-c2cn(Cc3cscn3)nn2)cc1Cl,PPGQVKDCNOBGNU-UHFFFAOYSA-N
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| 8405 |
rxn:1:65678:39067,Cc1cc(-c2cn(CC=Cc3ccsc3Cl)nn2)cc(C)n1,CQVFENQQBABZDK-UHFFFAOYSA-N
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| 8406 |
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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| 8404 |
rxn:1:64029:31372,CNCCc1ccc(-c2cn(Cc3cscn3)nn2)cc1Cl,PPGQVKDCNOBGNU-UHFFFAOYSA-N
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| 8405 |
rxn:1:65678:39067,Cc1cc(-c2cn(CC=Cc3ccsc3Cl)nn2)cc(C)n1,CQVFENQQBABZDK-UHFFFAOYSA-N
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| 8406 |
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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| 8407 |
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rxn:1:39929:1060,Cc1n[nH]c(N)c1C=CCn1cc(-c2cc(Br)cs2)nn1,SMFSVKQQWKEWHX-UHFFFAOYSA-N
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| 8408 |
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rxn:1:40466:39921,NCc1cc(F)ccc1C=CCn1cc(-c2ccc(I)nn2)nn1,UZGLLLOGILMNOZ-UHFFFAOYSA-N
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| 8409 |
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rxn:1:41487:2049,Cc1ccc(-n2cc(-c3ccc([C@@H](N)CO)cc3)nn2)c(Br)c1,FDNWKGAKEWHDTB-HNNXBMFYSA-N
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| 8410 |
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rxn:1:41662:7755,Cc1ccc(-n2cc(C3(C)CCCN3)nn2)cc1Br,GFFANRFUMIZXGC-UHFFFAOYSA-N
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| 8411 |
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rxn:1:41711:31452,Cc1cc(CO)ccc1-c1cn(-c2ccc(I)cc2Br)nn1,CDSPETFETVLAEU-UHFFFAOYSA-N
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| 8412 |
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rxn:1:41711:32016,NCc1ccc(-c2cn(-c3ccc(I)cc3Br)nn2)c(Cl)c1,MLWXBJGBQNGQTD-UHFFFAOYSA-N
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| 8413 |
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rxn:1:41711:32047,NCc1ccc(-c2cn(-c3ccc(I)cc3Br)nn2)cc1O,JONUEDGOJPTVMY-UHFFFAOYSA-N
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| 8414 |
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rxn:1:41711:32048,N[C@H](CO)c1ccc(-c2cn(-c3ccc(I)cc3Br)nn2)cn1,RHHXNAXISVOOLJ-GFCCVEGCSA-N
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| 8415 |
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rxn:1:41847:31445,Cc1cc(N)cc(-c2cn(CC=Cc3cscc3Br)nn2)c1,LQUUNSCISLSQTL-UHFFFAOYSA-N
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| 8416 |
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rxn:1:41899:8798,NCc1cccc(-c2cn(-c3cccc(C#CCS)c3)nn2)c1,GVHCHODWEVNBDU-UHFFFAOYSA-N
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| 8417 |
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rxn:1:41977:20489,Nc1ccncc1C#CCn1cc(-c2ncc(Br)cn2)nn1,ZUCNTVFOLGQXSH-UHFFFAOYSA-N
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| 8418 |
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rxn:1:47710:23881,CCC(C)(C)Cc1cn(-c2nccc3c(I)c[nH]c23)nn1,JKHFYYJCKGUJNZ-UHFFFAOYSA-N
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| 8419 |
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rxn:1:49388:12172,Cc1cc(C)c(-n2cc(C3(N)CCSC3)nn2)c(Br)c1,UDUFYLXHTKDJLA-UHFFFAOYSA-N
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| 8420 |
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rxn:1:55820:39921,Cc1c(N)cc(F)cc1C1CC1Cn1cc(-c2ccc(I)nn2)nn1,SVQDDJMAKRJPFL-UHFFFAOYSA-N
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| 8421 |
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rxn:1:55948:23913,CCCn1nc(C)c(-c2cn(CCI)nn2)c1C,PRXDFJHKOSZEOJ-UHFFFAOYSA-N
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| 8422 |
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rxn:1:57007:31957,Cc1ccsc1CCCn1cc(-c2cnc(F)cc2N)nn1,YBVZMBBZKDIDLE-UHFFFAOYSA-N
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| 8423 |
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rxn:1:57011:23650,CC(=O)c1ccnc(-c2cn(CCCc3cscc3Br)nn2)c1,OBRGDEJBZWJBRJ-UHFFFAOYSA-N
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| 8424 |
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rxn:1:57014:32362,NC1(c2cn(CCCc3cc(Br)cs3)nn2)CC(F)C1,AVVWKEKDQCMSPN-UHFFFAOYSA-N
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| 8425 |
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rxn:1:57037:39921,Cc1cnc(CCCn2cc(-c3ccc(I)nn3)nn2)s1,VZAPUKBYINXWLF-UHFFFAOYSA-N
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| 8426 |
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rxn:1:57399:8557,Cc1cnc(CCCn2cc(-c3csc(Br)c3)nn2)c(N)c1,PHAJPDPEHPQQAO-UHFFFAOYSA-N
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| 8427 |
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rxn:1:57801:1595,NCc1cc(F)ccc1CCCn1cc(-c2csc(Br)n2)nn1,VEVUPFFJQDTLOJ-UHFFFAOYSA-N
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| 8428 |
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rxn:1:59847:6355,Cc1cc(-c2cn([C@@H]3CCCCC[C@H]3I)nn2)ncc1F,MIOPDRVBXPOPQF-IUODEOHRSA-N
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| 8429 |
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rxn:1:61827:39557,CCNC(C)c1cn(-c2ccc(I)c(Br)c2)nn1,KRPAIHSDKCHOOH-UHFFFAOYSA-N
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| 8430 |
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rxn:1:62178:39089,Brc1ccc(-c2cn(-c3ccc4c(c3)CNCC4)nn2)s1,YNLCCWLWXLNACW-UHFFFAOYSA-N
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| 8431 |
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rxn:1:62327:2912,CC(CBr)Cn1cc(-c2ccc(C3(N)CCC3)cc2)nn1,PLTOPLQLDUTLTQ-UHFFFAOYSA-N
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| 8432 |
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rxn:1:62688:13972,CNC1(c2cn(-c3cc(I)cc(I)c3I)nn2)CC1,KTXWDOGNKGFHHT-UHFFFAOYSA-N
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| 8433 |
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rxn:1:62688:28236,O=CCC1(CCc2cn(-c3cc(I)cc(I)c3I)nn2)N=N1,UTTPCJPTIFZNFS-UHFFFAOYSA-N
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| 8434 |
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rxn:1:63510:31195,Fc1cc(Cl)ccc1-n1cc(-c2ccc3c(c2)CNC3)nn1,OWOBZIBKOZQECN-UHFFFAOYSA-N
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| 8435 |
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rxn:1:64168:3262,Cc1cc(Br)ccc1-n1cc(-c2c(C)nn(C)c2Cl)nn1,HIAVMJYSYVPGCC-UHFFFAOYSA-N
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| 8436 |
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rxn:1:65677:39709,Cc1cscc1C=CCn1cc(-c2cc(F)c(F)cc2N)nn1,VBQXOAHBDXPEPM-UHFFFAOYSA-N
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