smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
Cc1cc(C)c2cc3[nH]c4ccccc4c3cc2n1	6069669	FLRIZEAQTUTWHB-UHFFFAOYSA-N	246.313	4.486	5	30	BIBC	
C1=Cc2cc3ccccc3c3cccc1c23	2040925	SQFPKRNUGBRTAR-UHFFFAOYSA-N	202.256	4.477	5	30	BIBC	in-vitro
Cc1nc2c3ccccc3c3ccccc3c2o1	32256547	HTCNPDQEFIVXPS-UHFFFAOYSA-N	233.270	4.443	5	30	BIBC	
O=[N+]([O-])c1ccc2c(c1)-c1cccc3cccc-2c13	2019792	CTBYAQPHRFINGO-UHFFFAOYSA-N	247.253	4.395	5	30	BIBC	
O[C@H]1Cc2cc3cccc4ccc5ccc1c2c5c43	6094851	PRQSBOQMCBPXTR-HNNXBMFYSA-N	244.293	4.174	5	30	BIBC	
Cc1cnc2c(c1)c(C)c(C)c1cc(C)cnc12	2541491	RLTILZHOUNHUQL-UHFFFAOYSA-N	236.318	4.017	5	30	BIBC	
c1cc2c3c(c1)ccc1cccc(c13)[C@H]1O[C@@H]21	6094874	RJCXKHSGIOKCID-IYBDPMFKSA-N	218.255	4.119	5	30	BIBC	in-vitro
CCc1nc2ccccc2c2cc(C)ccc12	39102299	BPMUCMMMVQKCOD-UHFFFAOYSA-N	221.303	4.259	5	30	BIBC	
O[C@@H]1Cc2cc3cccc4ccc5ccc1c2c5c43	6094852	PRQSBOQMCBPXTR-OAHLLOKOSA-N	244.293	4.174	5	30	BIBC	
c1cc2c3c(c1)ccc1cccc(c13)[C@H]1O[C@H]21	100407760	RJCXKHSGIOKCID-HZPDHXFCSA-N	218.255	4.119	5	30	BIBC	in-vitro
CCCC[C@H](CC)C[N+](C)(C)CCCC	33606006	NWIHOJZOEJDBDM-AWEZNQCLSA-N	214.417	4.079	5	30	BIBC	
O=[N+]([O-])c1cccc2c(Cl)ccc(Cl)c12	1841053	UFYHMOUUBQRTOS-UHFFFAOYSA-N	242.061	4.055	5	30	BIBC	
Cc1ccc2cc3ccccc3cc2c1[N+](=O)[O-]	198468824	KSPCWZHTFNYWBB-UHFFFAOYSA-N	237.258	4.210	5	30	BIBC	
CCCC[C@H](CC)C[N+](C)(C)Cc1ccccc1	33610907	JCOUUFIKUNOYFC-INIZCTEOSA-N	248.434	4.479	5	30	BIBC	
Cn1c2ccccc2c2ccc3ccccc3c21	5420425	ODHVRMYJIOFUAK-UHFFFAOYSA-N	231.298	4.485	5	30	BIBC	
CCc1ccc2c3nc4ccccc4c-3ccn2c1	137877631	BAALMEGRQMMBJQ-UHFFFAOYSA-N	246.313	4.155	5	30	BIBC	
Cc1cc(C)c(-c2ccc([N+](=O)[O-])cc2)c(C)c1	32264222	HPUGSEVZDVNPQI-UHFFFAOYSA-N	241.290	4.187	5	30	BIBC	
c1cc2c3c(c1)ccc1cccc(c13)[C@@H]1O[C@@H]21	100407762	RJCXKHSGIOKCID-HOTGVXAUSA-N	218.255	4.119	5	30	BIBC	in-vitro
c1ccc2c(c1)oc1cc3scnc3cc12	45236193	RQQIGFGWPIAZEW-UHFFFAOYSA-N	225.272	4.196	5	30	BIBC	
CCCC[C@@H](CC)C[N+](C)(C)Cc1ccccc1	33610906	JCOUUFIKUNOYFC-MRXNPFEDSA-N	248.434	4.479	5	30	BIBC	
O=[N+]([O-])c1cccc2c1-c1cccc3cccc-2c13	2019793	JBCOKTTXCKLQBB-UHFFFAOYSA-N	247.253	4.395	5	30	BIBC	
CCCC[C@@H](CC)C[N+](C)(C)CCCC	33606004	NWIHOJZOEJDBDM-CQSZACIVSA-N	214.417	4.079	5	30	BIBC	
O=C1CCc2c1ccc1c2ccc2ccccc21	6118526	HODITXUVHFRFCL-UHFFFAOYSA-N	232.282	4.122	5	30	BIBC	
O=[N+]([O-])c1cccc(Cl)c1Oc1ccccc1	150518	JCTFSJDXLVTVRY-UHFFFAOYSA-N	249.653	4.041	5	30	BIBC	
O=[N+]([O-])c1ccc2cccc3c2c1-c1ccccc1-3	2019794	AWYZHUPAWKZJSL-UHFFFAOYSA-N	247.253	4.395	5	30	BIBC