Added 15 molecules from epoch 19118 for P31652
Browse files- P31652_molecules.csv +15 -0
P31652_molecules.csv
CHANGED
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@@ -50662,3 +50662,18 @@ rxn:4:221121:225267,CCCOc1ccc(-c2ccc3c(ccn3CC(=O)N3CCN(CC(=O)N4CCN(C)CC4)CC3)c2)
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| 50662 |
rxn:4:221151:223848,CCCCC[C@H]1CC[C@H](c2ccc(-c3cnc(OCC4CCCN(C(=O)c5cnccn5)C4)nc3)cc2)CC1,YDZVYXZULFWDLV-PECFQXNXSA-N
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| 50663 |
rxn:4:222126:225336,CN1CCN(Cc2nc3c(c(=O)n(C)c(=O)n3C)n2Cc2ccc(-c3ccc(COCC(F)(F)F)cc3F)cc2)CC1,OOFUTJCSYWYRSG-UHFFFAOYSA-N
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| 50664 |
rxn:5:193968:225702:223146,COC(=O)n1c(-c2ccc(-c3cccc(C4CNCCO4)c3)c(CN3CCC4(CC3)OCCO4)c2)cc2ccccc21,PUNUTZKIUSZTHV-UHFFFAOYSA-N
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| 50662 |
rxn:4:221151:223848,CCCCC[C@H]1CC[C@H](c2ccc(-c3cnc(OCC4CCCN(C(=O)c5cnccn5)C4)nc3)cc2)CC1,YDZVYXZULFWDLV-PECFQXNXSA-N
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| 50663 |
rxn:4:222126:225336,CN1CCN(Cc2nc3c(c(=O)n(C)c(=O)n3C)n2Cc2ccc(-c3ccc(COCC(F)(F)F)cc3F)cc2)CC1,OOFUTJCSYWYRSG-UHFFFAOYSA-N
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| 50664 |
rxn:5:193968:225702:223146,COC(=O)n1c(-c2ccc(-c3cccc(C4CNCCO4)c3)c(CN3CCC4(CC3)OCCO4)c2)cc2ccccc21,PUNUTZKIUSZTHV-UHFFFAOYSA-N
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| 50665 |
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rxn:4:173579:223784,CCOc1cccc(-c2cc(C(=O)OC(C)(C)C)cc(-c3ccc(OCCN4CCN(CC)CC4)c(F)c3)c2)c1,HCQMXCHTYXTMFI-UHFFFAOYSA-N
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| 50666 |
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rxn:4:173600:222621,CCOC(=O)c1c(C)oc2cc(-c3cc(CC(C)C)nc(C4CCCNC4)c3)c(OC(=O)CC)cc12,RXJPACQJXMAPDO-UHFFFAOYSA-N
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| 50667 |
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rxn:4:201779:224424,CCCC1CCC(c2ccc(-c3ccc(OCC(=O)N4CCN(C)CC4)cc3)cc2)CC1,YJMPCJSRVCOVJM-UHFFFAOYSA-N
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| 50668 |
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rxn:4:202203:223827,CCN1CCN(c2ccc(C(F)(F)F)cc2-c2ccc(CN3CCN(C)CC3)c(Oc3ccccc3)c2)CC1,YRFRTMOKKWCFLP-UHFFFAOYSA-N
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| 50669 |
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rxn:4:202274:223922,CN(C(=O)c1cc(-c2ccc([C@H]3CN(Cc4ccccc4)C[C@@H]3N(C)C)cc2)ccc1Cl)C1CCCCC1,LRONWQPTMCUZFW-BHYZAODMSA-N
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| 50670 |
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rxn:4:202284:223722,COc1ccc(-c2ccc(-c3ccc(OCCC(C)C)cc3)cc2)cc1CN1CCC(N2CCCC2)CC1,OHMZVIYNGPZRKX-UHFFFAOYSA-N
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| 50671 |
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rxn:4:212839:222686,CCN1CCN(C(C)c2c(C)c(C(=O)OC(C)C)cc3c(-c4cccc(Nc5ccc([N+](=O)[O-])cc5)c4)ccn23)CC1,RCBMQZCDHKJMAL-UHFFFAOYSA-N
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| 50672 |
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rxn:4:212839:223070,CCN1CCN(C(C)c2c(C)c(C(=O)OC(C)C)cc3c(-c4csc(NC(=O)OC(C)(C)C)c4)ccn23)CC1,IRORYJZWFFMXHS-UHFFFAOYSA-N
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| 50673 |
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rxn:4:213214:223728,CCCCCC1CCC(c2ccc(-c3cc(C(=O)OC(C)(C)C)cc(N4CCN(CC)CC4)n3)c(F)c2)CC1,NGPXIMRJXZNEHZ-UHFFFAOYSA-N
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| 50674 |
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rxn:4:213830:223848,CCCCC[C@H]1CC[C@H](c2ccc(-c3cnn(CC4CCN(CC(C)C)CC4)c3)cc2)CC1,HPXPIYARHZGOJK-DUYHBEBVSA-N
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| 50675 |
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rxn:4:213964:224035,CCCC[C@H]1CC[C@H](c2ccc(-c3ccc(F)c(CN4CCC(Oc5ncc(C)cn5)CC4)c3)cc2)CC1,CLWZDQCPXLEVAT-DIVCQZSQSA-N
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| 50676 |
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rxn:4:214079:224056,CCC[C@H]1CC[C@H](c2ccc(-c3ccc(CN4CCN(C(C)C)CC4)c(N4CCCC4)c3)c(F)c2)CC1,OADZPCBINRNKCU-MCZWQBSQSA-N
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| 50677 |
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rxn:4:214852:223497,CC(c1ccc(-c2cncc(C(=O)N3CCC(N4CCCC4)CC3)c2)cc1)N1CCC(O[Si](C)(C)C(C)(C)C)CC1,AANCFTPRDYJIHL-UHFFFAOYSA-N
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| 50678 |
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rxn:4:222126:223599,CN1CCN(Cc2nc3c(c(=O)n(C)c(=O)n3C)n2Cc2ccc(-c3cc4cc(C(F)(F)F)ccc4n3C(=O)OC(C)(C)C)cc2)CC1,XEAJAMHOHBKWNX-UHFFFAOYSA-N
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| 50679 |
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rxn:5:190127:225506:223054,COC1CCN(C(=O)c2cc(-c3ccc4c(cnn4CC(C)C)c3)ccc2-c2ccc(C(C)N3CCC(O)C3)s2)CC1,DRYGKWUZCFGFBB-UHFFFAOYSA-N
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