Added 34 molecules from epoch 21608 for Q01959

Q01959_molecules.csv

@@ -26202,3 +26202,37 @@ rxn:2:90688:87722,CCOc1ccc(C(C)NCC2CC3CCCC32)cc1C,AQGBITNMECAKDB-UHFFFAOYSA-N
 rxn:2:92382:169305,Cc1cc(-c2cc3ccccc3o2)ccc1C(C)Nc1cn[nH]c1,CBXGYFHVSZAJLY-UHFFFAOYSA-N
 rxn:2:94771:170913,Cc1cc(-c2cc3ccccc3s2)ccc1C(C)Nn1cnnc1,VLUDLVLVLVZTMW-UHFFFAOYSA-N
 rxn:2:97543:91563,Cc1cc(-c2ccco2)ccc1C(C)NCCc1nnn[nH]1,MRAYBTVQHHUPTA-UHFFFAOYSA-N
+rxn:1:45225:31214,Clc1ccc(Br)c(C#CCCn2cc(CBr)nn2)c1,GWNISRGHKKMRSM-UHFFFAOYSA-N
+rxn:2:105080:135410,CCCCC(Cc1ccc(C)c(C)c1)NCCc1cc[nH]c1,WDUOGWUGMIZKOC-UHFFFAOYSA-N
+rxn:2:106943:152446,CC(NC1CCOC(C(C)C)C1)c1ccc(C#Cc2ccccc2)cc1,IAFMBGZGTSFHFH-UHFFFAOYSA-N
+rxn:2:110352:172317,CCNC(CC)c1ccc(-c2ccc(SCC)cc2)cc1,CDECNIBEGLIYIW-UHFFFAOYSA-N
+rxn:2:110352:172405,CCNC(Cc1ccc(-c2ccc(C)cc2)cc1)c1cccnc1,MCJNMRZMVPIMNP-UHFFFAOYSA-N
+rxn:2:111848:152446,CC(Nc1nc(CS(C)(=O)=O)cs1)c1ccc(C#Cc2ccccc2)cc1,CLFQKLKAJZTJFB-UHFFFAOYSA-N
+rxn:2:113732:108959,CC(NCC#Cc1ccc2cc[nH]c2c1)c1ccc(-c2cccs2)cc1,VDZSGWSDGATPNE-UHFFFAOYSA-N
+rxn:2:114191:110334,Cc1ccc2cc(C(C)NCCCCc3ccc[nH]3)ccc2c1,NSFGVNDQTZCBHK-UHFFFAOYSA-N
+rxn:2:114204:170668,CC(NCC#Cc1cnccn1)c1csc(-c2ccc(-c3ccco3)cc2)c1,MWLCOLCGBYLZBJ-UHFFFAOYSA-N
+rxn:2:120936:70192,Cc1ccc(OCCC(C)NCCn2nccn2)c(C)c1,YGGCDESGVQFULV-UHFFFAOYSA-N
+rxn:2:125874:150277,COc1csc(-c2ccc(CCC(C)NCCCc3ccc4[nH]c(=O)sc4c3)cc2)c1,ZJJFVJMEDDGAGQ-UHFFFAOYSA-N
+rxn:2:127150:123403,Cc1ccc2cc(C(C)NCC3CCC(CN(C)C)CC3)sc2c1,CWWGJKCHIBZKCT-UHFFFAOYSA-N
+rxn:2:127558:173016,CC(NCCOc1ncccn1)c1cc(-c2ccc(-c3ccco3)cc2)cs1,TZPRLZAHPBXBLP-UHFFFAOYSA-N
+rxn:2:128114:168058,COc1ccc2c(c1)CCc1cc(C(C)NCCCSc3cc(C)ncn3)ccc1-2,AUUULXVDYREHEX-UHFFFAOYSA-N
+rxn:2:128153:170892,CC(NCc1onc2ncoc12)c1ccc(-c2cc3sccc3s2)s1,LWKCELJOLQXMRB-UHFFFAOYSA-N
+rxn:2:128583:172375,CC(NCCCC1CCCCO1)c1ccc(-c2cc3ccccc3o2)c2c1OCO2,UWFFKPFPYYHCST-UHFFFAOYSA-N
+rxn:2:141397:102942,CNC(C)c1cc2ccccn2c1,XJCZLRMNETTZDT-UHFFFAOYSA-N
+rxn:2:141397:144761,CNC(C)CCc1ccc(-c2ccc3c(c2)CC3)cc1,UZUCALXPLVAUQW-UHFFFAOYSA-N
+rxn:2:141397:167117,CNC1CC(c2cccc(-c3ccccc3)c2)C1,PNQYWRSXUPFRIW-UHFFFAOYSA-N
+rxn:2:141397:169028,CNC1CCc2cc(-c3cc(C)c(OC)cc3C)ccc2C1,HWELWEFKIRIZKB-UHFFFAOYSA-N
+rxn:2:141544:146828,CSCC(NCCSc1ncn[nH]1)c1ccc2cc(C)ccc2c1,ZRENQFUFLOLPST-UHFFFAOYSA-N
+rxn:2:150747:123403,Cc1ccc2cc(C(C)NCC#Cc3ccc4[nH]c(=O)[nH]c4c3)sc2c1,WNGSUFBQJAAEFK-UHFFFAOYSA-N
+rxn:2:156072:156984,COc1csc(-c2ccc(C(C)NCC#Cc3ccc4[nH]c(=O)oc4c3)c(C)c2)c1,JTJOEECFRYKOBX-UHFFFAOYSA-N
+rxn:2:67236:123403,Cc1ccc2cc(C(C)NCC3CC3c3cc[nH]n3)sc2c1,GIXJWQAKMACJLN-UHFFFAOYSA-N
+rxn:2:70411:110041,CC(NCC1CC1c1cnc2cc[nH]c2c1)c1csc(-c2ccsc2)c1,FALVVGXLBMSDMU-UHFFFAOYSA-N
+rxn:2:71469:169412,Cc1csc(-c2ccc(CCC(C)NCCC(C)Sc3nnnn3C)cc2)c1,BPGIWJHLFUYCBI-UHFFFAOYSA-N
+rxn:2:72317:170060,CCc1nc([C@H](CC)NC(C)CCc2ccc(-c3csc(C)c3)cc2)n[nH]1,FWDJRKBJNPHADG-MBABXSBOSA-N
+rxn:2:76896:96010,CC(NCCC#Cc1cccnc1)c1ccc(-c2ccsc2)cc1,BRTBAGUCQRYBKU-UHFFFAOYSA-N
+rxn:2:86385:172032,Cc1ccc(-c2ccc(C(C)NCc3c[nH]nn3)cc2)c(C)c1,LNZQRCLBWGFPGK-UHFFFAOYSA-N
+rxn:2:86385:172618,CC(NCc1c[nH]nn1)c1cc(-c2cc3sccc3s2)cs1,NKJSTSVHPPFRDU-UHFFFAOYSA-N
+rxn:2:87208:169305,COCCONC(C)c1ccc(-c2cc3ccccc3o2)cc1C,HCCFYIMXCPTJBQ-UHFFFAOYSA-N
+rxn:2:89554:90126,CC(NCC#Cc1cnc2nc[nH]c2c1)c1ccc(-c2ccsc2)cn1,BJIBIBYSRDBONT-UHFFFAOYSA-N
+rxn:2:89971:107408,CC(NCCC1CC1c1cnc2cc[nH]c2c1)c1ccc(-c2ccsc2)s1,HZTQLKXPMYQNIX-UHFFFAOYSA-N
+rxn:2:99048:170235,Cc1cccc(-c2ccc3oc(C(C)NC4CCC(S(C)(=N)=O)C4)cc3c2)c1,HGGVVEDLPYQNSR-UHFFFAOYSA-N