Added 30 molecules from epoch 21718 for P23977

P23977_molecules.csv

@@ -44418,3 +44418,33 @@ rxn:2:88943:170482,Cc1ccc2sc(-c3ccc(C(C)NC4CCC(OCCS(C)(=O)=O)CC4)s3)cc2c1,KLCHVS
 rxn:2:91717:173095,CC(Nc1[nH]ncc1N=O)c1ccc2sc3ccccc3c2c1,OAVFSIKKTLDWDR-UHFFFAOYSA-N
 rxn:2:92434:170060,Cc1cc(-c2ccc(CCC(C)NC(CC(C)C)c3nnn[nH]3)cc2)cs1,ZIUJTIYFNLZTSP-UHFFFAOYSA-N
 rxn:2:92882:170060,Cc1cc(-c2ccc(CCC(C)NCCCc3nccnc3C)cc2)cs1,LNWFSDQNZSKDNF-UHFFFAOYSA-N
+rxn:2:102070:169412,Cc1csc(-c2ccc(CCC(C)Nc3cncnc3OC3COC3)cc2)c1,VBIAUHLCTQETSY-UHFFFAOYSA-N
+rxn:2:102195:171231,CCOc1cc(C)c(-c2csc(C(C)N[C@H]3CC[C@H](COC)CC3)c2)cc1C,HCUCUUZMDACHME-OIFYPAEGSA-N
+rxn:2:105340:170940,COc1ccc2oc(-c3ccc(C(C)NCCS(=O)(=O)F)s3)cc2c1,JUDTUOWZBCMEKF-UHFFFAOYSA-N
+rxn:2:107302:172893,Cc1cc(-c2ccc3sccc3c2)ccc1C(C)Nc1cnn(C2CC2)n1,ZOIMNRASEPQSKW-UHFFFAOYSA-N
+rxn:2:108049:145184,c1ccc2c(C3CCC(NCCc4ccoc4)CC3)c[nH]c2c1,LOPCGLKXGQUZOS-UHFFFAOYSA-N
+rxn:2:111453:152446,CCS(=O)(=O)Cn1ccc(NC(C)c2ccc(C#Cc3ccccc3)cc2)n1,ANUJVBPWCALQGV-UHFFFAOYSA-N
+rxn:2:115091:169412,Cc1csc(-c2ccc(CCC(C)NCCc3c[nH]c(C(C)C)n3)cc2)c1,OQCJJALQGDPKLP-UHFFFAOYSA-N
+rxn:2:121028:155734,COc1ccc(-c2csc(C(C)NCCSc3cnccn3)c2)c(C)c1,ZHRKKHSMCDZPKD-UHFFFAOYSA-N
+rxn:2:126189:170060,Cc1cc(-c2ccc(CCC(C)NC3CCN(c4cccnc4)C3)cc2)cs1,GZOHOQJGCUHKIO-UHFFFAOYSA-N
+rxn:2:127204:170411,CCSc1ccc(-c2ccc(C(C)NCCCOS(C)(=O)=O)c(C)c2)cc1,RZVNXSGUBCZZHS-UHFFFAOYSA-N
+rxn:2:127429:152446,CN=S(C)(=O)c1cc(NC(C)c2ccc(C#Cc3ccccc3)cc2)ccn1,MBMZYKMWIWMUOO-UHFFFAOYSA-N
+rxn:2:127917:172375,COC(F)(F)CNC(C)c1ccc(-c2cc3ccccc3o2)c2c1OCO2,MVUPZWWVLUXJIA-UHFFFAOYSA-N
+rxn:2:128000:172105,CCCC(NCCCC1N=N1)c1ccc(-c2nc3ccc(C)cc3s2)cc1,IPLMTWAATLBHEQ-UHFFFAOYSA-N
+rxn:2:128000:172969,CCc1cccc(-c2ccc(C(CC)NCCCC3N=N3)c(C)c2)c1,SEFBCFZYYKATHX-UHFFFAOYSA-N
+rxn:2:129097:169810,COc1ccc2oc(-c3ccc(C(C)NCCCc4ncc(C)[nH]4)c(C)c3)cc2c1,ANUVLMHDWFIQLA-UHFFFAOYSA-N
+rxn:2:136407:172189,Cc1cn(CCCNC2CCC(c3ccc(-c4csc(C)c4)cc3)CC2)cn1,ZITYBDOIBNZGCP-UHFFFAOYSA-N
+rxn:2:138365:173089,Cc1cc(-c2cc3sccc3s2)ccc1C(C)NC1CC(c2cnccn2)C1,FCKRSLNKHMZJHV-UHFFFAOYSA-N
+rxn:2:139105:120822,Cc1ccc(-c2ccc(C(C)NCCC#Cc3ncc[nH]3)cc2)s1,UVZFOSOLGSLEGG-UHFFFAOYSA-N
+rxn:2:141397:171376,CNC1CCc2c(-c3ccc(-c4ccco4)cc3)cccc21,BBYMOHQMXAQXDZ-UHFFFAOYSA-N
+rxn:2:141397:72783,CNC1CCN(c2cc(C)ccc2OC)C(C)C1,BPGGGRYWEFXUKF-UHFFFAOYSA-N
+rxn:2:142033:170026,CCCC(NOC)c1ccc(-c2cc3cc(C)ccc3s2)cc1,ZGARBUQOXIYFMT-UHFFFAOYSA-N
+rxn:2:144636:170892,CC(NCCC#Cc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(-c2cc3sccc3s2)s1,ZUDPCAVONIMQBP-UHFFFAOYSA-N
+rxn:2:67236:171231,CCOc1cc(C)c(-c2csc(C(C)NCC3CC3c3cc[nH]n3)c2)cc1C,SGSFMAVOXLMZTM-UHFFFAOYSA-N
+rxn:2:70400:171231,CCOc1cc(C)c(-c2csc(C(C)NC3CC(S(C)(=N)=O)C3)c2)cc1C,MTPUWFAEBHAJOL-UHFFFAOYSA-N
+rxn:2:73728:93647,CCCC(NC1CC1)c1ccc2ccccc2c1,FBNVYTNAFLGUJZ-UHFFFAOYSA-N
+rxn:2:76425:171043,CCS(=O)(=O)CCCNC(C)CCc1ccc(-c2cc3ccccc3[nH]2)cc1,VBEOPTATGQWMRY-UHFFFAOYSA-N
+rxn:2:81600:152446,CC(NCC(F)c1cnc[nH]1)c1ccc(C#Cc2ccccc2)cc1,XDLTWLFKWBCSNV-UHFFFAOYSA-N
+rxn:2:82519:169412,Cc1csc(-c2ccc(CCC(C)NCCC3CC3c3c[nH]c(C)n3)cc2)c1,HWQIRETZWVYULZ-UHFFFAOYSA-N
+rxn:2:91903:115745,CCSCC(NCCc1nnc[nH]1)c1cccc2ccccc12,FSRYLPSQMAHCJP-UHFFFAOYSA-N
+rxn:2:94977:173089,Cc1cc(-c2cc3sccc3s2)ccc1C(C)NC(C)Cc1cnccn1,WLPWKRAXVJNTLJ-UHFFFAOYSA-N