Added 43 molecules from epoch 19539 for P23977

P23977_molecules.csv

@@ -36726,3 +36726,46 @@ rxn:4:215960:224331,Cc1cc(N2CCN(C)CC2)c(-c2ccc(-c3ccc(C(F)(F)F)cc3)nc2)cc1[N+](=
 rxn:4:217340:224251,CC1CCCN(C(=O)c2ccc(-c3cc([N+](=O)[O-])cc4nc[nH]c34)c(F)c2)C1,TVVYSGZCPBFXKP-UHFFFAOYSA-N
 rxn:4:224372:206000,O=C(c1cc(-c2cnc(-c3ccc(C(F)(F)F)cc3)nc2)cc([N+](=O)[O-])c1)N1CCCC1,OLDCRBACQKOJIX-UHFFFAOYSA-N
 rxn:4:227893:185754,CN(C)Cc1cccc(-c2cncc(OC(C(F)(F)F)C(F)(F)F)c2)c1,XTZVUMLBBSMUHC-UHFFFAOYSA-N
+rxn:4:176378:223279,FC(F)(F)COc1cccc(-c2cnc(C3CCCN3)nc2)c1,YBLSZEDTSGDHCU-UHFFFAOYSA-N
+rxn:4:178668:223240,Fc1cc(OC(F)(F)F)ccc1-c1ccc(C2CCNC2)nc1,WJJAEWKQVZRENP-UHFFFAOYSA-N
+rxn:4:179212:225923,CCC(=O)c1ccc(F)c(-c2cnc(OC3CCCC3)nc2Cl)c1,PRRNGQUKXWKNIR-UHFFFAOYSA-N
+rxn:4:179438:226382,COC(=O)c1cc(-c2cnc(C3CCCCC3)nc2)cc(F)c1C,AHYBMVDHGILIDH-UHFFFAOYSA-N
+rxn:4:179733:226794,CC(=O)c1cc(-c2cnc(N3CCSCC3)nc2)cc(C(C)(F)F)c1,VFFORTOSRSBROK-UHFFFAOYSA-N
+rxn:4:180084:227654,CC(=O)c1cc(-c2ccc(C3OCCO3)nc2)cc(C(C)C)c1,CGJPVUIBRQQAPE-UHFFFAOYSA-N
+rxn:4:180958:223130,OC1CN(Cc2ccc(-c3ccc(C(F)F)c(F)c3)cc2)C1,YQWPUQRONVVOOX-UHFFFAOYSA-N
+rxn:4:181523:226239,CCCOC(=O)c1ccc(-c2cc(C)cc(C(C)=O)c2)cc1,FNBFDSAETLDAFR-UHFFFAOYSA-N
+rxn:4:181523:226323,CC(=O)c1cc(C)cc(-c2ccc(OC3CCCC3)nc2)c1,RRZRWAJNSXRTGN-UHFFFAOYSA-N
+rxn:4:186545:225835,O=C(ON1C(=O)CCC1=O)c1cc(-c2cnc(-c3ccc(F)cc3)nc2)c(C(F)(F)F)cc1F,VHLHWSOMRQEHSK-UHFFFAOYSA-N
+rxn:4:188138:223199,O=[N+]([O-])c1cc(OC(F)F)ccc1-c1cccc(C2CCNC2)c1,LRAXFDDDRQUGIQ-UHFFFAOYSA-N
+rxn:4:191789:225802,COc1cc([N+](=O)[O-])cc(-c2ccc(OC3CCCC3)nc2F)c1Cl,QCFYCRMKNKMQIS-UHFFFAOYSA-N
+rxn:4:191828:222998,COc1nc(C(F)(F)F)ccc1-c1cc(F)cc(C2CCCNC2)c1,KLCXWVPHIMTMBO-UHFFFAOYSA-N
+rxn:4:192189:225802,COc1c(C)cc(-c2ccc(OC3CCCC3)nc2F)cc1[N+](=O)[O-],ZFQCJHRNBOQXMS-UHFFFAOYSA-N
+rxn:4:192580:228756,CSc1ccc(-c2cnc(OC3CCSC3)c(F)c2)c(C)n1,GGPBKUKSMMSDPS-UHFFFAOYSA-N
+rxn:4:193345:224386,Fc1cc(CN2CCOCC2)cc(-c2cnc(-c3cccc(C(F)(F)F)c3)nc2)c1,SBOMYTSQMRQXGM-UHFFFAOYSA-N
+rxn:4:194582:222926,Cc1nc(N2CCCC(O)C2)ncc1-c1ccc(-c2cc3cc(S(F)(F)(F)(F)F)ccc3[nH]2)cc1,PZGAEIJMPDKEAE-UHFFFAOYSA-N
+rxn:4:195062:222985,Cc1nc(C2CCCNC2)ccc1-c1ccc(N=C=S)cc1Cl,ICPXINCYUFTKGJ-UHFFFAOYSA-N
+rxn:4:195642:225300,Cc1cc(F)c(-c2ccc(OC3CCOCC3)nc2F)cc1[N+](=O)[O-],AUBSNUNHSGMGBP-UHFFFAOYSA-N
+rxn:4:195704:225208,Cc1nc(N2CCCC(C)C2)ncc1-c1cc([N+](=O)[O-])c(F)c(C)c1F,LHXNYPYBRKCYBL-UHFFFAOYSA-N
+rxn:4:195811:226730,COc1ncc(-c2cnc(OC3CCC3)nc2Cl)c(F)c1C,GEVYTQMZAAMNMT-UHFFFAOYSA-N
+rxn:4:195820:226025,Fc1c(-c2cnc(OC3CCOC3)nc2Cl)cnc(Cl)c1C1CC1,IRRCSNULKLWZCL-UHFFFAOYSA-N
+rxn:4:195820:227502,CC(C)Oc1ncc(-c2cnc(Cl)c(C3CC3)c2F)cc1Cl,NZGWGKGRQHJOOZ-UHFFFAOYSA-N
+rxn:4:195862:223062,Fc1cc(C2CCNCC2)ncc1-c1cncc(C2CC2(F)F)c1,GAYWOZFTXZROTN-UHFFFAOYSA-N
+rxn:4:196226:226587,Cc1cc(C2CC2)ncc1-c1cnc(OC2CCC2)cc1F,WPMFNIGAHGZXPO-UHFFFAOYSA-N
+rxn:4:196285:228330,CCOc1cc(-c2cncc(C3(C)CC3(F)F)c2)cnc1F,DPMLGTFSAZXYSJ-UHFFFAOYSA-N
+rxn:4:196671:227278,N#CC1(c2ccc(-c3nccc(C4CCCC4)c3F)cn2)CC1,MYFOSADLVCNAOI-UHFFFAOYSA-N
+rxn:4:196718:228216,O=C1CCOC(c2ccc(-c3cncc(C4CC4)c3Cl)nc2)C1,AWTUUCGBVCGRTO-UHFFFAOYSA-N
+rxn:4:198286:225923,Cc1nc(Cl)c(F)cc1-c1cnc(OC2CCCC2)nc1Cl,OFULOHNISYKGAK-UHFFFAOYSA-N
+rxn:4:201287:225579,CC(F)(F)COc1ncc(-c2ccc(-n3cccc3)cc2C#N)cc1C#N,VMSFZVNUYZLWMJ-UHFFFAOYSA-N
+rxn:4:201294:227735,Cc1ncc(-c2cnc(OCC3CC3)c(C#N)c2)cc1C(F)(F)F,QXPVSPKLEAEUBG-UHFFFAOYSA-N
+rxn:4:202306:222448,CCN1CCN(Cc2cc(-c3cc(C(=O)NCc4ccccc4)cc([N+](=O)[O-])c3)cc(C(C)(C)C)c2)CC1,ZZPYSJXLZQZPRV-UHFFFAOYSA-N
+rxn:4:203190:227703,COC(=O)c1cc(-c2cnc(OCC3CC(F)(F)C3)nc2)cnc1F,YJUIHIPFFBSWPK-UHFFFAOYSA-N
+rxn:4:205024:227381,N#Cc1ccc([N+](=O)[O-])cc1-c1cnc(C2CCCC2)nc1,MUYJPPIQPHXZJH-UHFFFAOYSA-N
+rxn:4:205045:226448,N#Cc1cc([N+](=O)[O-])cc(-c2cnc(Cl)c(C3CCCC3)c2)c1F,JVZMMOJMPHJYRF-UHFFFAOYSA-N
+rxn:4:205689:228226,Cc1c(Cl)cc(C#N)cc1-c1cnc(OC2CCOC2)nc1Cl,HUVGTLMROYCCTO-UHFFFAOYSA-N
+rxn:4:206044:226023,Fc1c(-c2cnc(OC3CCCC3)nc2)ccc(Cl)c1OCC(F)F,YTNIGMDLRMCMKS-UHFFFAOYSA-N
+rxn:4:207613:223179,CONC(=O)c1cc(-c2ccc(-c3nc4cc(S(F)(F)(F)(F)F)ccc4[nH]3)cc2)ccc1F,HGTHTEOZHXSKSR-UHFFFAOYSA-N
+rxn:4:207613:223306,FS(F)(F)(F)(F)c1ccc2[nH]c(-c3ccc(-c4ccc5c(c4)CNCC5)cc3)nc2c1,VUFVIUFNRYUAIW-UHFFFAOYSA-N
+rxn:4:208333:222925,Cc1c(-c2ccc(C3CNC3)c(C(F)(F)F)c2)cnn1C(F)(F)F,DVCWMLMCBDRMLW-UHFFFAOYSA-N
+rxn:4:209698:224980,O=C1CCCCN1c1ccc(-c2cc(C3CC3)cc(-n3cccn3)c2)cn1,YUJXSJFJTBDXEH-UHFFFAOYSA-N
+rxn:4:211294:222699,FC(F)(F)c1cc(-c2cnc3scnc3c2)ccc1C1CCCNC1,PKHVYUPRIOJXET-UHFFFAOYSA-N
+rxn:4:224331:197043,CN1CCC(c2cccc(-c3ccc(-c4ccc(C(F)(F)F)cc4)nc3)c2)CC1,OZEFSSWBQGMMIC-UHFFFAOYSA-N