Added 31 molecules from epoch 19816 for Q63380

Q63380_molecules.csv

@@ -4626,3 +4626,34 @@ rxn:4:222362:223667,CC1(C)CCN(Cc2ccc3nc(Cn4cc(-c5cc(-c6ccc(OC(F)(F)F)cc6OCc6cccc
 rxn:4:222362:223834,Cc1cc(-c2cc(-c3cn(Cc4cn5cc(CN6CCC(C)(C)CC6)ccc5n4)nn3)c3cn[nH]c3c2)cc(C)c1S(=O)(=O)N1CCN(C)CC1,RJAYFSTUHTUPGH-UHFFFAOYSA-N
 rxn:4:222363:223866,Cc1cc(CN2CCN(c3c(-c4ccccc4CN4C(C)(C)CCCC4(C)C)cnc4nc(-c5ccc(N6CCN(C)CC6)cc5)[nH]c34)CC2)no1,GXIXJHGNUZFDCC-UHFFFAOYSA-N
 rxn:4:222363:228951,Cc1cc(CN2CCN(c3c(-c4ccc(Cl)c(F)c4F)cnc4nc(-c5ccc(N6CCN(C)CC6)cc5)[nH]c34)CC2)no1,ASKKAQZEYDRWLG-UHFFFAOYSA-N
+rxn:4:178565:222423,COc1c(-c2ccc(-c3c(C)oc4cc(OC(C)=O)ccc4c3=O)cc2)cccc1-c1nc2ccc3[nH]ncc3c2c2c1CCC2,KFVFCWYXKFRGGW-UHFFFAOYSA-N
+rxn:4:187934:222423,COc1ccc(CN2Cc3cc(-c4cccc(-c5nc6ccc7[nH]ncc7c6c6c5CCC6)c4OC)ccc3OCC2=O)c(OC)c1,IGQGLQRPHZGBTQ-UHFFFAOYSA-N
+rxn:4:201132:222423,COc1ccc2cc(-c3cccc(-c4nc5ccc6[nH]ncc6c5c5c4CCC5)c3OC)ccc2c1CC(=O)N(C)C1CCN(C)CC1,YPQABSUHZCJVIA-UHFFFAOYSA-N
+rxn:4:202339:222423,COc1c(-c2ccc(-c3nc(S(=O)(=O)N4CCCC(C)C4)c(-c4ccc(Cl)cc4)o3)cc2)cccc1-c1nc2ccc3[nH]ncc3c2c2c1CCC2,CYOFIULBQRXZGK-UHFFFAOYSA-N
+rxn:4:202784:223578,COC(=O)c1ccc(C2c3c(oc4ccc(-c5cnc(N6CCCCC6)nc5OCc5ccccc5)cc4c3=O)C(=O)N2c2nc(C)cs2)cc1,PRINKICLFOFQJZ-UHFFFAOYSA-N
+rxn:4:202810:222423,COc1ccc(OC)c(C2c3c(oc4ccc(-c5cccc(-c6nc7ccc8[nH]ncc8c7c7c6CCC7)c5OC)cc4c3=O)C(=O)N2c2nc(C)c(C)s2)c1,ZFBRYKXZLQLEOL-UHFFFAOYSA-N
+rxn:4:212712:222423,COc1c(-c2ccc(-c3cnc(SCC(=O)N4CCCCC4)n3-c3ccccc3)cc2)cccc1-c1nc2ccc3[nH]ncc3c2c2c1CCC2,HQEPTEMDWSODAC-UHFFFAOYSA-N
+rxn:4:212748:224264,COc1cc(-c2cccc(Cl)c2)c(F)cc1-c1cc(CN2CCCCC2)cc(N2CCN(C(=O)OC(C)(C)C)C(C)C2)c1,UARIULITISUSDX-UHFFFAOYSA-N
+rxn:4:212846:224670,CC(=O)N1CCc2c(sc3nc(SCc4ccc(-c5cc(CN6CCN(C)CC6)ccc5F)cc4)n(Cc4ccco4)c(=O)c23)C1,VKJGXJWYOTZVSH-UHFFFAOYSA-N
+rxn:4:213445:223570,COc1ccc(-c2cnn3cc(C)c(-c4ccc5c(-c6c(F)ncc7c6ccn7[Si](C(C)C)(C(C)C)C(C)C)c(OC)ccc5c4)nc23)cc1OC,ULFOQAQLCFQUDW-UHFFFAOYSA-N
+rxn:4:213480:224013,CO[C@]12C[C@@H](COC(=O)c3cncc(-c4cnc(-c5ccc(C(F)(F)F)cc5)nc4Cl)c3)CN(C)[C@@H]1Cc1c[nH]c3cccc2c13,MWHDRDDUCRALTK-AVSRAWEBSA-N
+rxn:4:214344:223570,COc1ccc(N2C(=O)C3ON(c4ccc(-c5c(F)ncc6c5ccn6[Si](C(C)C)(C(C)C)C(C)C)cc4)C(c4cccnc4)C3C2=O)cc1,WACHNEHYDOSQRK-UHFFFAOYSA-N
+rxn:4:214362:224835,CCn1cc(-c2nc(-c3ccc(-c4cc(C(F)(F)F)nn4S(=O)(=O)N(C)C)cc3)cs2)c(=O)c2cc(F)c(N3CCCCCC3)cc21,KSKKPCUTQQSUFJ-UHFFFAOYSA-N
+rxn:4:214388:223363,COc1ccc2[nH]c3c(c2c1)CN(C(=O)c1c(C)n(C)c2cc(-c4cnc5[nH]nc(C)c5c4)c(OC)cc12)CC3,YHMPFFGUCQWUSN-UHFFFAOYSA-N
+rxn:4:218764:223980,CCN1CCN(S(=O)(=O)c2cccc(-c3nc4c(c(=O)n(CCCc5ccccc5)c(=O)n4C)n3Cc3ccccc3Cl)c2)CC1,UBKMCFWAWXETRO-UHFFFAOYSA-N
+rxn:4:219189:222694,COc1ccc(-c2cccc(S(=O)(=O)NC3CCCCC3)c2)cc1-c1nc(Cn2ccn3nc(-c4ccc(C)c(C)c4)cc3c2=O)c(C)o1,WCZYXXASEHIBCT-UHFFFAOYSA-N
+rxn:4:219780:222811,CC(=O)N1CCc2c(c(N3CCCc4cc(-c5cc(Cl)nc(NC(=O)OC(C)(C)C)c5)c(C(F)F)cc43)nn2C2CCOCC2)C1,XHDGEHCQRIBKHG-UHFFFAOYSA-N
+rxn:4:221761:224670,CN1CCN(Cc2ccc(F)c(-c3ccc(N4CCCn5c4nc4c5c(=O)n(Cc5c(F)cccc5Cl)c(=O)n4C)cc3)c2)CC1,FURIALOZYYMUHR-UHFFFAOYSA-N
+rxn:4:221765:222700,Cc1ccc(Cn2c(=O)c3c(nc4n(-c5ccc(-c6ccc(C(F)(F)F)cc6C6CCCNC6)cc5)c(C)cn34)n(C)c2=O)cc1,GPUXPUQJGREYKW-UHFFFAOYSA-N
+rxn:4:221772:222996,CC1CN(c2ccc(-c3ccc(F)cc3C3CCCNC3)cc2)c2nc3c(c(=O)n(Cc4ccccc4)c(=O)n3C)n2C1,OKOSWYWCVWERSH-UHFFFAOYSA-N
+rxn:4:221782:223063,Cc1ccc(N2CCCn3c2nc2c3c(=O)n(Cc3ccc(-c4cc(F)nc(C5CCNCC5)c4)cc3)c(=O)n2C)c(C)c1,GMJYJBNZHVTQIM-UHFFFAOYSA-N
+rxn:4:221791:223105,CNS(=O)(=O)c1cc(-c2ccc(N3CCCn4c3nc3c4c(=O)n(Cc4cccc5ccccc45)c(=O)n3C)cc2)c(F)cc1C,XWZLNTRVAAQWKX-UHFFFAOYSA-N
+rxn:4:221986:223479,CCN1CCN(Cc2nc3c(c(=O)n(C)c(=O)n3C)n2Cc2ccc(-c3ccc(-c4cc(-c5ccccn5)nc(-c5ccccn5)c4)cc3)cc2)CC1,WWBRXQBPTTUGDI-UHFFFAOYSA-N
+rxn:4:222133:223994,Cc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1-c1ccc(-c2nnc3n(CCc4ccccc4)c4c(=O)n(C)c(=O)n(C)c4n23)cc1,ZKELUXKCNVITJO-UHFFFAOYSA-N
+rxn:4:222135:222537,COc1ccc(-c2cc(C3CCCC3)nc(C3CCCNC3)c2)cc1-c1nnc2n(Cc3ccccc3)c3c(=O)n(C)c(=O)n(C)c3n12,RUTHALMXMYSZKP-UHFFFAOYSA-N
+rxn:4:222245:222700,CCOc1ccc(-n2nnc3c(=O)n(Cc4nc(-c5ccccc5-c5ccc(C(F)(F)F)cc5C5CCCNC5)no4)cnc32)cc1,NHOOGIPYDJTHSJ-UHFFFAOYSA-N
+rxn:4:222250:222700,Cc1cn2c3c(=O)n(Cc4ccc(-c5ccc(C(F)(F)F)cc5C5CCCNC5)cc4)c(=O)n(C)c3nc2n1CCCn1ccnc1,HKRLDWVUAFRKEC-UHFFFAOYSA-N
+rxn:4:222339:222483,Cc1ccc(NC(=O)c2ccc(F)c(-c3cncc(N4CCN(c5cc(N6CCN(C)CC6)nc(C)n5)CC4)c3)c2)c(C)c1,ILFRSQSHQTWKME-UHFFFAOYSA-N
+rxn:4:222362:223159,CCNC(=O)c1ccc(-c2cc(-c3cn(Cc4cn5cc(CN6CCC(C)(C)CC6)ccc5n4)nn3)c3cn[nH]c3c2)cc1Cl,BHIVDWALSYACPZ-UHFFFAOYSA-N
+rxn:4:222362:224114,CC1(C)CCN(Cc2ccc3nc(Cn4cc(-c5cc(-c6cc(F)ccc6OCCc6ccccc6)cc6[nH]ncc56)nn4)cn3c2)CC1,SAVBSNQXVOHBGB-UHFFFAOYSA-N
+rxn:4:222363:224464,CCc1ccc(-c2ccc(-c3cnc4nc(-c5ccc(N6CCN(C)CC6)cc5)[nH]c4c3N3CCN(Cc4cc(C)on4)CC3)c(F)c2)cc1,CGGGOQACVJGUCV-UHFFFAOYSA-N