smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
O=S(=O)(Cl)CCCn1cnnn1	1535543809	VNRWYQNOZMNHAY-UHFFFAOYSA-N	210.646	-0.368	70	30	BBIC	
CO[C@@H]1COC[C@@H]1S(=O)(=O)Cl	238855686	SQVLOCURKZSIMR-UHNVWZDZSA-N	200.643	-0.031	70	30	BBIC	
CS(=O)(=O)N1CC(CS(=O)(=O)Cl)C1	307400469	AMYOCAVKECMURS-UHFFFAOYSA-N	247.725	-0.554	70	30	BBIC	
CC(=O)OC1CN(S(=O)(=O)Cl)C1	1535646154	GKXWDTDGXBHTDV-UHFFFAOYSA-N	213.642	-0.283	70	30	BBIC	
CN([C@@H]1CCS(=O)(=O)C1)S(=O)(=O)Cl	59402304	FHGYCADQYQRNIN-RXMQYKEDSA-N	247.725	-0.411	70	30	BBIC	
CN1[C@@H](CS(=O)(=O)Cl)CCS1(=O)=O	716258086	YNJAWFPJICFHMK-RXMQYKEDSA-N	247.725	-0.411	70	30	BBIC	
N#C[C@H]1CN(S(=O)(=O)Cl)CCO1	118811128	ASWATQIEVMUVKV-YFKPBYRVSA-N	210.642	-0.306	70	30	BBIC	in-vitro
CN1[C@H](CS(=O)(=O)Cl)CCS1(=O)=O	716258087	YNJAWFPJICFHMK-YFKPBYRVSA-N	247.725	-0.411	70	30	BBIC	
O=C(O)[C@@H]1CCCN(S(=O)(=O)F)C1	2265361413	NHVSGUVKNULCSJ-RXMQYKEDSA-N	211.214	-0.003	70	30	BBIC	
CN1CCN(CCS(=O)(=O)Cl)CC1	103595462	QJQBFCLTSPZBGT-UHFFFAOYSA-N	226.729	-0.198	70	30	BBIC	
O=C(O)[C@H]1CCCN(S(=O)(=O)F)C1	2265361414	NHVSGUVKNULCSJ-YFKPBYRVSA-N	211.214	-0.003	70	30	BBIC	
O=C1NC(=O)[C@H](CCS(=O)(=O)Cl)N1	100363748	CGGFOZFJXDOHDD-VKHMYHEASA-N	226.641	-0.847	70	30	BBIC	
O=S(=O)(Cl)CC1CS(=O)(=O)C1	642882548	KSDALRIWYAVHGP-UHFFFAOYSA-N	218.683	-0.400	70	30	BBIC	
O=C1NC(=O)[C@@H](CCS(=O)(=O)Cl)N1	100363753	CGGFOZFJXDOHDD-GSVOUGTGSA-N	226.641	-0.847	70	30	BBIC	
NS(=O)(=O)CI	111336144	FDGDRDDFTVNCGU-UHFFFAOYSA-N	221.019	-0.333	70	30	BBIC	
CN(C)S(=O)(=O)CCS(=O)(=O)Cl	238854225	MXZKTMVWPBZFRV-UHFFFAOYSA-N	235.714	-0.554	70	30	BBIC	
CN([C@H]1CCS(=O)(=O)C1)S(=O)(=O)Cl	59402305	FHGYCADQYQRNIN-YFKPBYRVSA-N	247.725	-0.411	70	30	BBIC	
CCOC(=O)CNS(=O)(=O)Cl	147117029	UNTDTIMKVXGOPS-UHFFFAOYSA-N	201.631	-0.377	70	30	BBIC	
O=S(=O)(Cl)C[C@H]1CCS(=O)(=O)C1	100559512	GVGQILJHSCPTFL-YFKPBYRVSA-N	232.710	-0.010	70	30	BBIC	
O=S(=O)(Cl)CCC1CS(=O)(=O)C1	258846118	LUVWLRMRKXMDHK-UHFFFAOYSA-N	232.710	-0.010	70	30	BBIC	
COC(=O)CN(C)S(=O)(=O)Cl	59118897	JBQFIIQUUCBBDQ-UHFFFAOYSA-N	201.631	-0.425	70	30	BBIC	
O=S(=O)(CCO)CCBr	82004738	NZIJXOYVFWERQQ-UHFFFAOYSA-N	217.084	-0.212	70	30	BBIC	
CS(=O)(=O)NCCS(=O)(=O)Cl	148789971	UAVLXTXNUIDFJO-UHFFFAOYSA-N	221.687	-0.896	70	30	BBIC	
CCOC(=O)CN(C)S(=O)(=O)Cl	100648447	SKJKGVDXYYQGPE-UHFFFAOYSA-N	215.658	-0.035	70	30	BBIC	
C[C@@]1(CS(=O)(=O)Cl)NC(=O)NC1=O	59688664	GXBXYLVXNQXXNV-YFKPBYRVSA-N	226.641	-0.847	70	30	BBIC	
CCS(=O)(=O)NCCS(=O)(=O)Cl	100439109	IGZDHFKWRYPSSU-UHFFFAOYSA-N	235.714	-0.506	70	30	BBIC	in-vitro
Cc1nn(CCS(=O)(=O)Cl)c(=O)o1	536948663	AWAIPQIRWKLEBI-UHFFFAOYSA-N	226.641	-0.287	70	30	BBIC	
NS(=O)(=O)CCCCS(=O)(=O)Cl	584880065	XHNUNJSQXSHRBN-UHFFFAOYSA-N	235.714	-0.376	70	30	BBIC	
O=S(=O)(Cl)C[C@@H]1CCS(=O)(=O)C1	100559510	GVGQILJHSCPTFL-RXMQYKEDSA-N	232.710	-0.010	70	30	BBIC	
CO[C@@H]1CN(S(=O)(=O)Cl)C[C@H]1OC	234814210	PYRONDRDMQNIIM-PHDIDXHHSA-N	229.685	-0.184	70	30	BBIC	
N#C[C@@H]1CN(S(=O)(=O)Cl)CCO1	118811126	ASWATQIEVMUVKV-RXMQYKEDSA-N	210.642	-0.306	70	30	BBIC	in-vitro
COC(=O)C1CN(S(=O)(=O)Cl)C1	958678650	BTAXIPIOPGMSQU-UHFFFAOYSA-N	213.642	-0.425	70	30	BBIC	
C[C@]1(CS(=O)(=O)Cl)NC(=O)NC1=O	59688667	GXBXYLVXNQXXNV-RXMQYKEDSA-N	226.641	-0.847	70	30	BBIC	
CC1(CS(=O)(=O)Cl)CS(=O)(=O)C1	687827016	GIWQQKGRNLBLRI-UHFFFAOYSA-N	232.710	-0.010	70	30	BBIC	
COC(=O)CCN(C)S(=O)(=O)Cl	100647814	SQTDUFWMFSDGBA-UHFFFAOYSA-N	215.658	-0.035	70	30	BBIC	in-vitro