Added 17 molecules from epoch 19117 for P31652
Browse files- P31652_molecules.csv +17 -0
P31652_molecules.csv
CHANGED
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@@ -50645,3 +50645,20 @@ rxn:4:219453:224424,CCCC1CCC(c2ccc(-c3cnn(CC4CN(C5CCN(C(C)C)C5=O)C4)c3)cc2)CC1,Y
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| 50645 |
rxn:4:219997:222615,CC(C)Cc1cc(-c2ccc(N3CCN(c4nccn(C5CC5)c4=O)CC3)cc2)cc(C2CCNCC2)c1,VTNJUVLILSGRET-UHFFFAOYSA-N
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| 50646 |
rxn:4:221121:223605,CN1CCN(C(=O)CN2CCN(C(=O)Cn3ccc4cc(-c5ccc(Oc6ccc(C(F)(F)F)cc6[N+](=O)[O-])cc5)ccc43)CC2)CC1,WSXFFZYUPYTVJH-UHFFFAOYSA-N
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| 50647 |
rxn:5:190200:226395:222987,Cc1nc(C2CCNCC2)ccc1-c1cc(CN(C)C2CCOCC2)cc(-c2cncc(N3CCCCC3)c2)c1,NZIFOAKAKQEMLL-UHFFFAOYSA-N
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| 50645 |
rxn:4:219997:222615,CC(C)Cc1cc(-c2ccc(N3CCN(c4nccn(C5CC5)c4=O)CC3)cc2)cc(C2CCNCC2)c1,VTNJUVLILSGRET-UHFFFAOYSA-N
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| 50646 |
rxn:4:221121:223605,CN1CCN(C(=O)CN2CCN(C(=O)Cn3ccc4cc(-c5ccc(Oc6ccc(C(F)(F)F)cc6[N+](=O)[O-])cc5)ccc43)CC2)CC1,WSXFFZYUPYTVJH-UHFFFAOYSA-N
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| 50647 |
rxn:5:190200:226395:222987,Cc1nc(C2CCNCC2)ccc1-c1cc(CN(C)C2CCOCC2)cc(-c2cncc(N3CCCCC3)c2)c1,NZIFOAKAKQEMLL-UHFFFAOYSA-N
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| 50648 |
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rxn:4:175939:223689,CCN1CCN(S(=O)(=O)c2cc(-c3ccc(COC4CCCCO4)cc3OC)ccc2OC)CC1,NSNVSGDALFEJTE-UHFFFAOYSA-N
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| 50649 |
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rxn:4:191097:222542,CC1=CC(C)(C)N(C(=O)OC(C)(C)C)c2ccc(-c3ccc(C)c(OCCCN4CCNCC4)c3)cc21,CILLZUDCWOGIIK-UHFFFAOYSA-N
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| 50650 |
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rxn:4:192115:222466,Cc1cc(-c2cc(C3CCCCC3)nc(C3CCNCC3)c2)c([N+](=O)[O-])cc1C(F)(F)F,FANPVIBYBIDILH-UHFFFAOYSA-N
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| 50651 |
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rxn:4:200880:224205,COC1CCN(C2CCN(C(=O)Cc3ccc(-c4cc(F)cc(F)c4OCc4ccccc4)cc3)CC2)CC1,UXLRVCNMEFQVBX-UHFFFAOYSA-N
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| 50652 |
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rxn:4:201991:224060,COc1c(C(C)(C)C)cc(-c2ccc(OCCN3CCN(C)CC3)c(Cl)c2C)cc1C(C)(C)C,ZNLBDJOLAWOJMK-UHFFFAOYSA-N
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| 50653 |
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rxn:4:203902:225059,COc1c(Cl)cc(C(=O)N2CCN(C)CC2)cc1-c1ccc(N2CCC(C)CC2)cc1Cl,QSLKOYPFQOACPJ-UHFFFAOYSA-N
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| 50654 |
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rxn:4:212839:224284,CCN1CCN(C(C)c2c(C)c(C(=O)OC(C)C)cc3c(-c4cnc(OCc5ccc(OC)cc5)nc4)ccn23)CC1,MKNGNOGEVZBHNZ-UHFFFAOYSA-N
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| 50655 |
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rxn:4:212843:225386,CN1CCN(c2ccc(-c3cc(F)c(C(F)(F)F)cc3[N+](=O)[O-])c3c2C[C@H](N(Cc2ccccc2)Cc2ccccc2)CC3)CC1,RRHDURZITXQGSP-HHHXNRCGSA-N
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| 50656 |
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rxn:4:212843:226834,CN1CCN(c2ccc(-c3cncc(OCC(F)(F)F)c3)c3c2C[C@H](N(Cc2ccccc2)Cc2ccccc2)CC3)CC1,BHYVJCAQWWOJAK-SSEXGKCCSA-N
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| 50657 |
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rxn:4:213380:223847,CCCCCC1CCC(c2ccc(-c3ccc(-n4c(SCC(=O)N5CCCCC5)nc5c(c4=O)SCC5)cc3)cc2)CC1,HOVFVHHSNUHNBN-UHFFFAOYSA-N
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| 50658 |
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rxn:4:214889:224423,CCC[C@H]1CC[C@H](c2ccc(-c3ccc(CN4CCN(C)CC4)c(N4CCCC4)c3)cc2)CC1,CQZPJBWJBXGIOK-DIVCQZSQSA-N
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| 50659 |
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rxn:4:218772:223664,O=C(CN1CCN(C(=O)Cn2ccc3cc(-c4ccc(COc5ccc(OC(F)(F)F)cc5)cc4)ccc32)CC1)N1CCOCC1,LJLNWNMDTCQJJW-UHFFFAOYSA-N
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| 50660 |
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rxn:4:221121:222437,CN1CCN(C(=O)CN2CCN(C(=O)Cn3ccc4cc(-c5ccc(C(=O)Nc6ccc(OC(F)(F)F)cc6)cc5)ccc43)CC2)CC1,QVUYAAPIAWMYII-UHFFFAOYSA-N
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| 50661 |
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rxn:4:221121:225267,CCCOc1ccc(-c2ccc3c(ccn3CC(=O)N3CCN(CC(=O)N4CCN(C)CC4)CC3)c2)c(C(F)(F)F)c1,WULLITQFHVNRCQ-UHFFFAOYSA-N
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| 50662 |
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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 |
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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 |
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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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