Added 32 molecules from epoch 21581 for Q01959

Q01959_molecules.csv

@@ -25368,3 +25368,35 @@ rxn:2:87971:98332,Cc1ccc2c(C(C)N[C@H]3CC[C@H](CCN(C)C)CC3)cccc2c1,QZQIWVCWCUDETA
 rxn:2:90359:152446,CC(N[C@@H]1CCO[C@@H](C(C)C)C1)c1ccc(C#Cc2ccccc2)cc1,IAFMBGZGTSFHFH-QLGUMYEUSA-N
 rxn:2:93795:135410,CCCCC(Cc1ccc(C)c(C)c1)NCCc1c[nH]c(C)n1,VYWVDEFNOJSYKQ-UHFFFAOYSA-N
 rxn:2:95416:112875,Cc1ccc(C#CCCNC2CC(C#Cc3cccs3)C2)cc1,DNXFOGIUMCYGNE-UHFFFAOYSA-N
+rxn:2:100097:113826,CCCOc1ccc(C(C)NC2CCC(CCN(C)C)CC2)cc1C,JLCFHZBWMATAOW-UHFFFAOYSA-N
+rxn:2:102928:173089,Cc1cc(-c2cc3sccc3s2)ccc1C(C)Nc1ccon1,LXYTZKASRCZBMZ-UHFFFAOYSA-N
+rxn:2:103573:170913,CCc1[nH]ncc1NC(C)c1ccc(-c2cc3ccccc3s2)cc1C,IMIPYTVFWPQNTF-UHFFFAOYSA-N
+rxn:2:109905:171231,CCOc1cc(C)c(-c2csc(C(C)NC(C)CCOC)c2)cc1C,PDIBXELBXTVTMT-UHFFFAOYSA-N
+rxn:2:110405:169412,Cc1csc(-c2ccc(CCC(C)NCC3CCCCn4cnnc43)cc2)c1,FNXJLHMMFJGUSV-UHFFFAOYSA-N
+rxn:2:111985:169349,Cc1ccc(-c2ccc(C3CCC(NCCCc4cc[nH]n4)CC3)cc2)cc1,SUGFGXHSMNJZKJ-UHFFFAOYSA-N
+rxn:2:114213:150766,C=C=Cc1ccc2scc(C(C)Nc3c[nH][nH]c3=O)c2c1,UPKWQXRRGCKENT-UHFFFAOYSA-N
+rxn:2:120356:156984,COc1csc(-c2ccc(C(C)NCCC#Cc3c[nH]c(C)n3)c(C)c2)c1,ZKJAISOGGSFSTJ-UHFFFAOYSA-N
+rxn:2:122432:169412,CCCCSc1n[nH]c(NC(C)CCc2ccc(-c3cc(C)cs3)cc2)n1,XFJVMKBNVJPUCN-UHFFFAOYSA-N
+rxn:2:122495:170060,Cc1ncc(NC(C)CCc2ccc(-c3csc(C)c3)cc2)cn1,ZGPGKWIEMZXQRK-UHFFFAOYSA-N
+rxn:2:122668:169412,Cc1csc(-c2ccc(CCC(C)NCCc3nc(=O)o[nH]3)cc2)c1,JOYOTKLGBHMDBR-UHFFFAOYSA-N
+rxn:2:122723:87722,CCOc1ccc(C(C)NC2CCCC(S(=O)(=O)C(C)C)C2)cc1C,KWXQLRDLBFDULH-UHFFFAOYSA-N
+rxn:2:123488:152446,Cc1ccc(NC(C)c2ccc(C#Cc3ccccc3)cc2)[nH]c1=O,JDBOZSCGJBOXMX-UHFFFAOYSA-N
+rxn:2:127440:170235,Cc1cccc(-c2ccc3oc(C(C)Nc4cnns4)cc3c2)c1,BOCSRRPSODTGQU-UHFFFAOYSA-N
+rxn:2:133009:169305,Cc1cc(-c2cc3ccccc3o2)ccc1C(C)NCc1cc(=O)[nH]s1,DROBFMIEICTXRN-UHFFFAOYSA-N
+rxn:2:137524:130267,CC(NC[C@H]1CC[C@H](CN2CCC2)CC1)c1ccc2ccsc2c1,OREKMSOLGWHLFV-ZNUUHSPMSA-N
+rxn:2:138255:113826,CCCOc1ccc(C(C)N[C@H]2CC[C@@H](CCN(C)C)CC2)cc1C,JLCFHZBWMATAOW-UFPSUTMSSA-N
+rxn:2:141847:170913,Cc1cc(-c2cc3ccccc3s2)ccc1C(C)Nn1cnnn1,NSUFYRZOYOMZJX-UHFFFAOYSA-N
+rxn:2:149481:150277,COc1csc(-c2ccc(CCC(C)NCC3CC3c3cnc4[nH]c(=O)oc4c3)cc2)c1,UQVLTDUUPGEDNK-UHFFFAOYSA-N
+rxn:2:167169:171392,O=c1[nH]c2ccc(C#CCNC3CCC(c4csc5ccccc45)CC3)cc2s1,MVOSQZMYJGUXLI-UHFFFAOYSA-N
+rxn:2:67380:109025,Cc1csc(-c2cc(C(C)NC3CCC4(CC3)CCN(C)CC4)cs2)c1,WUWPJOTUXDQMTI-UHFFFAOYSA-N
+rxn:2:67741:169412,Cc1csc(-c2ccc(CCC(C)NCc3ncncn3)cc2)c1,VSWPLNBAYKFJEJ-UHFFFAOYSA-N
+rxn:2:68737:112875,C(#Cc1cc[nH]n1)CCNC1CC(C#Cc2cccs2)C1,MKGRGNCPOWXADN-UHFFFAOYSA-N
+rxn:2:73173:169412,CCOCc1cc(CNC(C)CCc2ccc(-c3cc(C)cs3)cc2)ncn1,YEYNNPQSQVUGTR-UHFFFAOYSA-N
+rxn:2:74737:169412,Cc1csc(-c2ccc(CCC(C)NCCC3CC3c3ccn(C)n3)cc2)c1,LAUOBUVPOYAQTI-UHFFFAOYSA-N
+rxn:2:85122:123403,Cc1ccc2cc(C(C)NCCc3c[nH]nn3)sc2c1,KLWPRISMNQZGBD-UHFFFAOYSA-N
+rxn:2:85122:173089,Cc1cc(-c2cc3sccc3s2)ccc1C(C)NCCc1c[nH]nn1,IHBCGGFOVIIQKA-UHFFFAOYSA-N
+rxn:2:86811:118142,Cc1cccc2c(C(C)NC3CCC(CC4CCN(C)C4)CC3)coc12,UYQWFRKLAJYIPT-UHFFFAOYSA-N
+rxn:2:87971:113826,CCCOc1ccc(C(C)N[C@H]2CC[C@H](CCN(C)C)CC2)cc1C,JLCFHZBWMATAOW-OIFYPAEGSA-N
+rxn:2:89509:172751,Cc1cc(-c2ccc(-c3cccs3)s2)ccc1C(C)Nc1cncc(=O)[nH]1,ITSQZBUVAKWQDC-UHFFFAOYSA-N
+rxn:2:97024:156984,COc1csc(-c2ccc(C(C)NCCC#Cc3cscn3)c(C)c2)c1,CJKGHLCUPJMVDX-UHFFFAOYSA-N
+rxn:2:97543:150277,COc1csc(-c2ccc(CCC(C)NCCc3nnn[nH]3)cc2)c1,LVKBXTVMFFXDBM-UHFFFAOYSA-N