smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
Cn1c(N)c([C@H](C[N+](=O)[O-])c2c(F)cccc2Cl)c(=O)n(C)c1=O	1046085	UZSBXDGNEGFDJS-SSDOTTSWSA-N	356.741	0.867	5	30	FCBC	
COc1ccc2nc3c(cc2c1)c(=O)n(C)c1c3c(=O)n(C)c(=O)n1C	1042201	ODGFWFUOMYRACP-UHFFFAOYSA-N	352.350	0.646	5	30	FCBC	
CC(=O)N[C@H]1[C@H](Oc2ccccc2[N+](=O)[O-])OC[C@@H](O)[C@@H]1OC(C)=O	95921509	PELDLXKYYZLNKB-RZFFKMDDSA-N	354.315	0.127	5	30	FCBC	
COc1ccc(C[N+](C)(CCCNC=O)CCCNC=O)cc1[N+](=O)[O-]	6068235	HHRQBLOWGUMNDG-UHFFFAOYSA-O	367.426	0.822	5	30	FCBC	
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1c1ccc([N+](=O)[O-])cc1	31284250	SYSQXFJVTDHGLI-RLSLPTNOSA-N	372.341	0.351	5	30	FCBC	
C[C@@H]([C@H](c1ccc2c(c1)OCO2)c1c(N)n(C)c(=O)n(C)c1=O)[N+](=O)[O-]	1046171	HORFOIKWYHREQI-QPUJVOFHSA-N	362.342	0.192	5	30	FCBC	
C[C@H]([C@@H](c1ccc2c(c1)OCO2)c1c(N)n(C)c(=O)n(C)c1=O)[N+](=O)[O-]	1046170	HORFOIKWYHREQI-PELKAZGASA-N	362.342	0.192	5	30	FCBC	
C[N+](C)(C)C[C@H](O)COCCCCCCOC[C@@H](O)C[N+](C)(C)C	6068137	ONTVADZKXQPMSJ-ROUUACIJSA-N	350.544	0.714	5	30	FCBC	
Cn1c(=O)c2c3nc4cc([N+](=O)[O-])ccc4cc3c(=O)n(C)c2n(C)c1=O	1044064	VJAMUUQRINPMCX-UHFFFAOYSA-N	367.321	0.546	5	30	FCBC	
C[N+](C)(C)C[C@@H](O)COCCCCCCOC[C@H](O)C[N+](C)(C)C	6068149	ONTVADZKXQPMSJ-QZTJIDSGSA-N	350.544	0.714	5	30	FCBC	
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1c1ccc([N+](=O)[O-])cc1	31284242	SYSQXFJVTDHGLI-DDFXLWFNSA-N	372.341	0.351	5	30	FCBC	
CC(=O)Oc1ccc2c3c1O[C@H]1C(=O)CC[C@@]4(O)[C@@H](C2)[N@+](C)([O-])CC[C@]314	2265352200	VPYXYWUIIQLAED-RBUQIHAASA-N	359.378	0.978	5	30	FCBC	
C[N+](C)(C)C[C@H](O)COCCCCCCOC[C@H](O)C[N+](C)(C)C	31361674	ONTVADZKXQPMSJ-HDICACEKSA-N	350.544	0.714	5	30	FCBC	
Cn1c(=O)c2c3nc4ccc([N+](=O)[O-])cc4cc3c(=O)n(C)c2n(C)c1=O	1036808	PCUMRUALWJXBRU-UHFFFAOYSA-N	367.321	0.546	5	30	FCBC	
O=[N+]([O-])c1cc([N+](=O)[O-])c(OCC(F)([N+](=O)[O-])[N+](=O)[O-])c([N+](=O)[O-])c1	100069258	UTIOXNJCGBCKFQ-UHFFFAOYSA-N	365.142	0.967	5	30	FCBC	
COc1cccc(F)c1[C@H](C[N+](=O)[O-])c1c(N)n(C)c(=O)n(C)c1=O	1046175	DQAXUFHBWMQUGP-QMMMGPOBSA-N	352.322	0.223	5	30	FCBC	
C[C@H]([C@H](c1ccc2c(c1)OCO2)c1c(N)n(C)c(=O)n(C)c1=O)[N+](=O)[O-]	1046172	HORFOIKWYHREQI-PRHODGIISA-N	362.342	0.192	5	30	FCBC	
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1c1ccc([N+](=O)[O-])cc1	31284248	SYSQXFJVTDHGLI-QQHRNGFRSA-N	372.341	0.351	5	30	FCBC	
COc1cccc(F)c1[C@@H](C[N+](=O)[O-])c1c(N)n(C)c(=O)n(C)c1=O	1046176	DQAXUFHBWMQUGP-MRVPVSSYSA-N	352.322	0.223	5	30	FCBC	
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@@H]1c1ccc([N+](=O)[O-])cc1	31284245	SYSQXFJVTDHGLI-KTSGXFQWSA-N	372.341	0.351	5	30	FCBC	
Cn1c(N)c([C@@H](C[N+](=O)[O-])c2c(F)cccc2Cl)c(=O)n(C)c1=O	1046084	UZSBXDGNEGFDJS-ZETCQYMHSA-N	356.741	0.867	5	30	FCBC	
CC(=O)Oc1ccc2c3c1O[C@H]1C(=O)CC[C@@]4(O)[C@@H](C2)[N@@+](C)([O-])CC[C@]314	2265352199	VPYXYWUIIQLAED-OITRIXBGSA-N	359.378	0.978	5	30	FCBC	
C[C@@H]([C@@H](c1ccc2c(c1)OCO2)c1c(N)n(C)c(=O)n(C)c1=O)[N+](=O)[O-]	1046169	HORFOIKWYHREQI-UFBFGSQYSA-N	362.342	0.192	5	30	FCBC