Added 41 molecules from epoch 21856 for P23977

P23977_molecules.csv

@@ -49634,3 +49634,44 @@ rxn:5:198085:223312:229258,Fc1cncc(-c2cnc(-c3ccc(C4CNC4)cc3)s2)c1,FSLWMDNIVQZMES
 rxn:5:198088:228980:223199,C#Cc1cccc(-c2nc(-c3cccc(C4CCNC4)c3)cs2)c1,PULXYCFGOWMZAB-UHFFFAOYSA-N
 rxn:5:198230:223312:229289,Cc1cc(-c2cscc2C)ncc1-c1ccc(C2CNC2)cc1,CRTFBIFTELLGLP-UHFFFAOYSA-N
 rxn:5:198408:223200:229334,c1cc2sc(-c3ccc(C4CCNC4)cc3)nc2cc1-c1cnoc1,CTRPKQZWWJMEAW-UHFFFAOYSA-N
+rxn:5:176755:223312:229330,CCOCc1cc(-c2ccsc2)ccc1-c1ccc(C2CNC2)cc1,DRFUHKSRIBHORN-UHFFFAOYSA-N
+rxn:5:178711:228996:228692,C#CCc1cc(-c2ccnc(CC)c2)ccc1-c1ccc(CN(C)C)s1,ZCUJCOVHDZVPAL-UHFFFAOYSA-N
+rxn:5:178711:228999:228545,C#CCc1cc(-c2cncc(C#C)c2)ccc1-c1cccc(CC#N)c1,GTXCSXNYGUQHHE-UHFFFAOYSA-N
+rxn:5:178713:228692:228944,C#CCc1cc(-c2cc(F)cc(F)c2F)ccc1-c1ccc(CN(C)C)s1,RTGJPAMELDCJPV-UHFFFAOYSA-N
+rxn:5:179177:228695:229313,CO/C=C/c1cc(-c2cc(C)ns2)ccc1-c1csc(CN(C)C)c1,BVOMOTNKLCIPEB-BQYQJAHWSA-N
+rxn:5:180877:228695:229293,C#Cc1ccc(-c2csc(C)c2)c(-c2csc(CN(C)C)c2)c1,VDYNINIHTJTQGE-UHFFFAOYSA-N
+rxn:5:180879:223311:228982,C#Cc1ccc(-c2ccc(-c3cccc(C4CNC4)c3)c(C#C)c2)cc1,QJDGSTVTHWVUOD-UHFFFAOYSA-N
+rxn:5:180879:229204:223200,C#Cc1cc(-c2ccc(C3CCNC3)cc2)ccc1-c1ccsc1CC,NCTZHMDODJGPGG-UHFFFAOYSA-N
+rxn:5:180880:222959:229345,C#Cc1cc(-c2ccc(C3CCNCC3)c(C)c2)cc(-c2ccno2)c1,CKTCNFWFUHBNRH-UHFFFAOYSA-N
+rxn:5:181735:229332:223311,c1cc(-c2ccc(-c3ccc(-c4ccoc4)cc3)cc2)cc(C2CNC2)c1,IXLCQIDOZVMYRA-UHFFFAOYSA-N
+rxn:5:182442:223306:229342,c1cc(-c2ccc3c(c2)CNCC3)ccc1-c1cnsc1,VXBBQKGWQBWZIP-UHFFFAOYSA-N
+rxn:5:182442:223311:229057,c1cc(-c2ccc(-c3cnn(C4CC4)c3)cc2)cc(C2CNC2)c1,MXWDNSJVVKQDNG-UHFFFAOYSA-N
+rxn:5:182442:228695:228999,C#Cc1cncc(-c2ccc(-c3csc(CN(C)C)c3)cc2)c1,AGZLKQJAHNNOJS-UHFFFAOYSA-N
+rxn:5:182442:228944:223200,Fc1cc(F)c(F)c(-c2ccc(-c3ccc(C4CCNC4)cc3)cc2)c1,FJAXUQIBPMCVRN-UHFFFAOYSA-N
+rxn:5:182500:223398:229226,CNCc1ccc(-c2ccc(-c3ccc(C#N)s3)cc2C)cc1,RWXFYHWBEAUMJZ-UHFFFAOYSA-N
+rxn:5:182500:223398:229308,CNCc1ccc(-c2ccc(-c3cc(C)no3)cc2C)cc1,UVMDCCCNWVBXBG-UHFFFAOYSA-N
+rxn:5:182502:223200:229294,Cc1cc(-c2ccc(-c3ccc(C4CCNC4)cc3)cc2C)co1,KQLWWYWKCALLJY-UHFFFAOYSA-N
+rxn:5:182502:228695:229331,Cc1cc(-c2csc(CN(C)C)c2)ccc1-c1cccs1,MGXWVJHWIKZOOD-UHFFFAOYSA-N
+rxn:5:182639:223312:223463,c1c[nH]c(-c2ccc3sc(-c4ccc(C5CNC5)cc4)cc3c2)c1,NBFYXBGNBKRYLC-UHFFFAOYSA-N
+rxn:5:182641:223199:229320,Fc1csc(-c2ccc3c(-c4cccc(C5CCNC5)c4)coc3c2)c1,XOEYSBXIRXLQMB-UHFFFAOYSA-N
+rxn:5:182647:228727:223464,COc1ncc(C)cc1-c1cc2ccc(-c3cc[nH]c3)cc2s1,PBOQMFCBFDRKHI-UHFFFAOYSA-N
+rxn:5:182653:223312:229336,c1cc(-c2cncs2)c2occ(-c3ccc(C4CNC4)cc3)c2c1,NMJZZYWVDIMLLW-UHFFFAOYSA-N
+rxn:5:182653:223421:229330,CNC(C)c1ccc(-c2coc3c(-c4ccsc4)cccc23)s1,QGWHNDYDFKVVBP-UHFFFAOYSA-N
+rxn:5:182892:228588:223464,CC#Cc1cc(-c2ccc3c(c2)CCC3c2cc[nH]c2)ccn1,QQCCJJYTIZWLIX-UHFFFAOYSA-N
+rxn:5:189244:228512:229330,CC#Cc1cccc(-c2ccc(-c3ccsc3)c(CCN(C)C)c2)c1,ILENIRLKJMWLSA-UHFFFAOYSA-N
+rxn:5:192492:229230:229228,CN(C)Cc1ccc(-c2cc(C#N)cs2)c(-c2ccsc2C#N)c1,JIMRSFPFOBOHQG-UHFFFAOYSA-N
+rxn:5:193681:223468:223464,CN1CCC(Oc2cc(-c3c[nH]cn3)ccc2-c2cc[nH]c2)CC1,FHAFIRAFQHLUQS-UHFFFAOYSA-N
+rxn:5:193681:228992:229320,CN1CCC(Oc2cc(-c3cccc(C#N)c3)ccc2-c2cc(F)cs2)CC1,SPBNQHICNHCTIF-UHFFFAOYSA-N
+rxn:5:193681:229227:229230,CN1CCC(Oc2cc(-c3csc(C#N)c3)ccc2-c2cc(C#N)cs2)CC1,OHEWTWTZJPNNGC-UHFFFAOYSA-N
+rxn:5:193681:229336:229137,CN1CCC(Oc2cc(-c3cncs3)ccc2-c2c(F)cccc2F)CC1,YAWLHUDFPLSRPR-UHFFFAOYSA-N
+rxn:5:193681:229337:229131,CN1CCC(Oc2cc(-c3cnco3)ccc2-c2ccc(F)cc2F)CC1,XOJPWGACOARJCO-UHFFFAOYSA-N
+rxn:5:193681:229345:228480,CN1CCC(Oc2cc(-c3ccno3)ccc2-c2cc(F)ccc2[N+](=O)[O-])CC1,IRTOVHLTGFPWTL-UHFFFAOYSA-N
+rxn:5:194934:223311:229320,C#Cc1nc(-c2cc(F)cs2)ccc1-c1cccc(C2CNC2)c1,NXUJLDQHRLCUNI-UHFFFAOYSA-N
+rxn:5:194934:223311:229331,C#Cc1nc(-c2cccs2)ccc1-c1cccc(C2CNC2)c1,QGYQCPPFEWVXLN-UHFFFAOYSA-N
+rxn:5:194941:223312:229332,N#Cc1ccc(-c2ccc(C3CNC3)cc2)cc1-c1ccoc1,XNFPMTSXQMMCPG-UHFFFAOYSA-N
+rxn:5:198120:223400:229205,CCc1csc(-c2ccc(-c3cccc(CNC)c3)cn2)c1,SGUNXQKCKLFAFD-UHFFFAOYSA-N
+rxn:5:198122:223311:229006,CSc1ccc(-c2ccc(-c3cccc(C4CNC4)c3)nc2)cc1,OCRFZSOEHXHAAQ-UHFFFAOYSA-N
+rxn:5:198122:223312:229011,c1cc(C2CNC2)ccc1-c1ccc(-c2ccc(C3CC3)s2)cn1,AUUQHZMEGCLHTH-UHFFFAOYSA-N
+rxn:5:198199:229294:223311,Cc1cc(-c2ccc(-c3cccc(C4CNC4)c3)[n+]([O-])c2)co1,PZESWPASOXDTQU-UHFFFAOYSA-N
+rxn:5:198227:223400:229288,CNCc1cccc(-c2ccc(-c3ccc(C)s3)nc2C)c1,FBEGHAPIUADNOW-UHFFFAOYSA-N
+rxn:5:198230:223400:229217,CNCc1cccc(-c2cnc(-c3ccc(F)cc3)cc2C)c1,QLMYZUBHLKNBGF-UHFFFAOYSA-N