Added 33 molecules from epoch 21681 for P23977

P23977_molecules.csv

@@ -43199,3 +43199,36 @@ rxn:2:83484:146828,CSCC(Nc1cnnn1C)c1ccc2cc(C)ccc2c1,JQSYQGDWFKTOIN-UHFFFAOYSA-N
 rxn:2:84871:127220,Cc1ccc(-c2cc(C(C)NCCC3CC3c3cnccn3)cs2)s1,NMZROXFVENUZTP-UHFFFAOYSA-N
 rxn:2:88848:169412,Cc1csc(-c2ccc(CCC(C)NCCC#Cc3ncccn3)cc2)c1,RCBUVJWZFMCODI-UHFFFAOYSA-N
 rxn:2:92462:142183,N=CCNc1ccc2cccc3c2c1CC3,MMTPORFFBMBJJF-UHFFFAOYSA-N
+rxn:2:107531:120822,Cc1ccc(-c2ccc(C(C)NCc3nn[nH]n3)cc2)s1,SVLHKTDMHZYHJV-UHFFFAOYSA-N
+rxn:2:110352:110334,CCNC(C)c1ccc2cc(C)ccc2c1,OKPHHKXIDWLERC-UHFFFAOYSA-N
+rxn:2:112079:169412,CSc1ncc(CCCNC(C)CCc2ccc(-c3cc(C)cs3)cc2)cn1,SDORWESLYODDIL-UHFFFAOYSA-N
+rxn:2:116191:70812,Cc1cc(C#CCCNC2CCC(c3ccccc3)CC2)cs1,YJOCQVFFSCZGCX-UHFFFAOYSA-N
+rxn:2:122923:150277,COc1csc(-c2ccc(CCC(C)NCCCc3ccc4[nH]c(=O)[nH]c4c3)cc2)c1,ARJSLFAPXNTMAC-UHFFFAOYSA-N
+rxn:2:133307:172751,Cc1cc(-c2ccc(-c3cccs3)s2)ccc1C(C)NCCc1cn[nH]n1,RFSSWAISGINOGL-UHFFFAOYSA-N
+rxn:2:137085:142183,CCCC(NCC=N)c1cc2cc(C)ccc2o1,UPWBPDLXCYPKRF-UHFFFAOYSA-N
+rxn:2:139686:170060,Cc1cc(-c2ccc(CCC(C)NC[C@@H]3C[C@H]3c3cnn(C)c3)cc2)cs1,NMDVNFYOQQABBO-LQERJKSESA-N
+rxn:2:142033:171231,CCOc1cc(C)c(-c2csc(C(C)NOC)c2)cc1C,IMYSFJGUBWATPX-UHFFFAOYSA-N
+rxn:2:150747:169412,Cc1csc(-c2ccc(CCC(C)NCC#Cc3ccc4[nH]c(=O)[nH]c4c3)cc2)c1,BAQHRGNYKPTPGW-UHFFFAOYSA-N
+rxn:2:158617:142183,N=CCNc1cccc2c1Cc1ccccc1-2,QZJMSWVBHVDWFS-UHFFFAOYSA-N
+rxn:2:162493:120181,CC(NCC#Cc1ccc2c(=O)[nH]cnc2c1)c1ccc(-c2ccsn2)cc1,ADMBXXBNFPUGNW-UHFFFAOYSA-N
+rxn:2:167169:111147,CC(NCC#Cc1ccc2[nH]c(=O)sc2c1)c1ccc(-c2nccs2)cc1,YYDCBFBCLYYDKZ-UHFFFAOYSA-N
+rxn:2:66636:169412,Cc1csc(-c2ccc(CCC(C)NCc3cc[nH]c3)cc2)c1,UYEKIQWUKUQJAM-UHFFFAOYSA-N
+rxn:2:68805:88103,CCCc1[nH]ncc1NC(COC)c1cc2ccccc2s1,VBYFTSIZNAMWGV-UHFFFAOYSA-N
+rxn:2:69951:142183,COc1ccc(C#CCNCC=N)c(C)c1,NVIUVSBUHKVGHU-UHFFFAOYSA-N
+rxn:2:72890:171231,CCOc1cc(C)c(-c2csc(C(C)NCCCCc3c[nH]cn3)c2)cc1C,MYVCXRAZSCNUDS-UHFFFAOYSA-N
+rxn:2:73951:171492,CC(Nc1cn[nH]c(=O)c1)c1ccc(-c2cc3ccccc3s2)cc1,DDBMGQCBECMQOF-UHFFFAOYSA-N
+rxn:2:75149:169412,CCc1noc(CCCNC(C)CCc2ccc(-c3cc(C)cs3)cc2)n1,SPFGFIFWJLVBSE-UHFFFAOYSA-N
+rxn:2:75149:171231,CCOc1cc(C)c(-c2csc(C(C)NCCCc3nc(CC)no3)c2)cc1C,BJXBGYJIZWOSGL-UHFFFAOYSA-N
+rxn:2:75620:169412,Cc1csc(-c2ccc(CCC(C)NCCC(C)S(=O)(=O)F)cc2)c1,WITCPAFPOIVIPS-UHFFFAOYSA-N
+rxn:2:76625:120822,Cc1ccc(-c2ccc(C(C)NCCC#Cc3cnc[nH]3)cc2)s1,JKHDJEPVALQRFF-UHFFFAOYSA-N
+rxn:2:78366:169412,Cc1csc(-c2ccc(CCC(C)NCCCc3cn(C)nc3C)cc2)c1,WIZIQILIJFIVII-UHFFFAOYSA-N
+rxn:2:78481:152446,COC1COCC(NC(C)c2ccc(C#Cc3ccccc3)cc2)C1,GCGMJYUPNRXYON-UHFFFAOYSA-N
+rxn:2:78535:120822,Cc1ccc(-c2ccc(C(C)NCC#Cc3cnc4cn[nH]c4c3)cc2)s1,RVGJGQNDOPXIBY-UHFFFAOYSA-N
+rxn:2:79834:169412,Cc1csc(-c2ccc(CCC(C)NC[C@@H](C)c3nc(-c4cn[nH]c4)no3)cc2)c1,IVOYAFNMTCWKQJ-TZHYSIJRSA-N
+rxn:2:82050:172618,CC(NCc1n[nH]c(=O)o1)c1cc(-c2cc3sccc3s2)cs1,XRWSQOSIOCGSLK-UHFFFAOYSA-N
+rxn:2:84668:169305,Cc1cc(-c2cc3ccccc3o2)ccc1C(C)NCCn1cccn1,QHBMNIZIMICRQL-UHFFFAOYSA-N
+rxn:2:88299:169412,Cc1csc(-c2ccc(CCC(C)NCCC#Cc3ncc(C)s3)cc2)c1,QGJFUIVNGFLZJC-UHFFFAOYSA-N
+rxn:2:88848:96010,CC(NCCC#Cc1ncccn1)c1ccc(-c2ccsc2)cc1,IWTVOGBBPVVJPJ-UHFFFAOYSA-N
+rxn:2:90290:142183,Cc1cccc(C#CCNCC=N)c1,TVXKTMRXYMNXIS-UHFFFAOYSA-N
+rxn:2:92382:170813,CCC(Nc1cn[nH]c1)c1ccc(-c2cc3cc(OC)ccc3o2)cc1,LZPVYDZGEIFLGA-UHFFFAOYSA-N
+rxn:2:92749:172893,Cc1cc(-c2ccc3sccc3c2)ccc1C(C)Nc1nnn[nH]1,LJNLYUXDIWUUEA-UHFFFAOYSA-N