smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
CC(C)(C)OC(=O)N1CCC[C@@H](CCS(=O)(=O)Cl)C1	757122117	PFPPDJLYJBXJHF-JTQLQIEISA-N	311.831	2.592	70	30	DFIC	
O=S(=O)(Cl)c1c(F)cc(F)c(Br)c1F	1857787580	MFYBTMZFHCBXPD-UHFFFAOYSA-N	309.490	2.794	70	30	DFIC	
CC(C)(C)OC(=O)N1CCC[C@@H](CS(=O)(=O)Cl)CC1	407985985	WILWNVQOKSGXME-SNVBAGLBSA-N	311.831	2.592	70	30	DFIC	
CC(C)(C)OC(=O)NCCc1ccc(S(=O)(=O)Cl)cc1	1535647597	VJOUJZQVQXOKTM-UHFFFAOYSA-N	319.810	2.681	70	30	DFIC	
COC(F)(F)C(F)(F)c1ccc(S(=O)(=O)Cl)cc1	1535543434	NHPQPYYBZCSJRH-UHFFFAOYSA-N	306.664	2.945	70	30	DFIC	
O=S(=O)(Cl)N=[S@@](=O)(c1ccccc1)C(F)(F)F	325416126	VLLRMEJYXYHQGO-MRXNPFEDSA-N	307.702	2.517	70	30	DFIC	
COc1cc(F)c(Br)cc1S(=O)(=O)Cl	216303835	QBLXNFVISLUNDW-UHFFFAOYSA-N	303.536	2.524	70	30	DFIC	
COc1c(Br)ccc(F)c1S(=O)(=O)Cl	687824102	QGFWPPCWGLPQOU-UHFFFAOYSA-N	303.536	2.524	70	30	DFIC	
COc1ccc(Br)c(F)c1S(=O)(=O)Cl	1535643543	IRTYQIGJCYUEGM-UHFFFAOYSA-N	303.536	2.524	70	30	DFIC	
Cn1cc(S(=O)(=O)Cl)c2cc(Br)ccc21	2265383620	FRACTYKUHUWAFE-UHFFFAOYSA-N	308.584	2.868	70	30	DFIC	
O=S(=O)(Cl)c1cc2c(Br)cncc2s1	958619876	AWCAZDDYYPVIIU-UHFFFAOYSA-N	312.597	2.986	70	30	DFIC	
CC(C)(C)OC(=O)N1CCCC[C@H]1CCS(=O)(=O)Cl	757115559	BMDHFEZLJFMRTM-JTQLQIEISA-N	311.831	2.735	70	30	DFIC	
O=C(Cl)c1cc(S(=O)(=O)Cl)ccc1OC(F)(F)F	725268760	UWKSNOBZTGWNTG-UHFFFAOYSA-N	323.075	2.892	70	30	DFIC	
COCOc1cc(Cl)cc(Cl)c1S(=O)(=O)Cl	725262637	MGINOXDJQYPLAU-UHFFFAOYSA-N	305.566	2.904	70	30	DFIC	
Cc1cc(Br)c([N+](=O)[O-])cc1S(=O)(=O)Cl	97972444	IEBCZZRSOZMANI-UHFFFAOYSA-N	314.544	2.593	70	30	DFIC	
N#Cc1c(Br)ccc(S(=O)(=O)Cl)c1Cl	230547751	FYKOKNDSBDLOHV-UHFFFAOYSA-N	314.975	2.902	70	30	DFIC	
COc1cc(Br)c(F)cc1S(=O)(=O)Cl	97956517	NHUNHVWVWOIQFW-UHFFFAOYSA-N	303.536	2.524	70	30	DFIC	in-vitro
Cc1c(Br)cc(S(=O)(=O)Cl)cc1[N+](=O)[O-]	100652180	SCOFBPIFCHKTSQ-UHFFFAOYSA-N	314.544	2.593	70	30	DFIC	in-vitro
Cc1ccc(S(=O)(=O)Cl)c(I)c1	238469873	VEYFOQOZMRRLPB-UHFFFAOYSA-N	316.547	2.527	70	30	DFIC	
CC(C)(C)OC(=O)N1CCC[C@H](CCS(=O)(=O)Cl)C1	757122118	PFPPDJLYJBXJHF-SNVBAGLBSA-N	311.831	2.592	70	30	DFIC	
CC(C)(C)OC(=O)N1CCc2c1cccc2S(=O)(=O)Cl	1535645044	PXYVFFUFRIVEKN-UHFFFAOYSA-N	317.794	2.912	70	30	DFIC	
CC(C)(C)OC(=O)NCc1ccc(S(=O)(=O)Cl)cc1	381905411	IPKPYHIHJKGWIM-UHFFFAOYSA-N	305.783	2.639	70	30	DFIC	
COc1ccc(Br)c(S(=O)(=O)Cl)c1F	642882267	MRVCUOWEVVOJBX-UHFFFAOYSA-N	303.536	2.524	70	30	DFIC	
Cc1ccc(S(=O)(=O)Cl)cc1I	100548983	ZEXWBLNNMZWGDT-UHFFFAOYSA-N	316.547	2.527	70	30	DFIC	
O=C(Nc1ccc(S(=O)(=O)Cl)cc1Cl)C(F)(F)F	103335283	NZZVIISZKMELCU-UHFFFAOYSA-N	322.091	2.768	70	30	DFIC	
CC(C)(C)OC(=O)N1CCC(CCS(=O)(=O)Cl)CC1	757120922	CHKJGJHEXRJFCO-UHFFFAOYSA-N	311.831	2.592	70	30	DFIC	
O=C(c1cccc(Cl)c1)N1CCC[C@@H](S(=O)(=O)Cl)C1	97971334	VGGNXGNNQOMLAI-LLVKDONJSA-N	322.213	2.513	70	30	DFIC	in-vitro
CC(=O)N1CCC(C)(C)c2cc(S(=O)(=O)Cl)ccc21	675050694	IADYPNRGHMKCPI-UHFFFAOYSA-N	301.795	2.648	70	30	DFIC	
CC(C)(C)OC(=O)N1CCCC[C@@H]1CCS(=O)(=O)Cl	757115581	BMDHFEZLJFMRTM-SNVBAGLBSA-N	311.831	2.735	70	30	DFIC	
Cn1cc(S(=O)(=O)Cl)c2c(Br)cccc21	2265383708	VESILZMZIMGDFX-UHFFFAOYSA-N	308.584	2.868	70	30	DFIC	
O=S(=O)(Cl)c1cc(Br)cc(Cl)c1O	127544760	WOZNSELJEQMAAU-UHFFFAOYSA-N	305.964	2.736	70	30	DFIC	
CC(=O)Nc1c(Cl)cc(S(=O)(=O)Cl)cc1Cl	59108284	XGEZVQCGXVMIPK-UHFFFAOYSA-N	302.566	2.879	70	30	DFIC	
O=S(=O)(Cl)CCC(F)(F)C(F)(F)Br	221380200	PLGPYICAYSTZLQ-UHFFFAOYSA-N	307.490	2.568	70	30	DFIC	
O=S(=O)(Cl)c1ccc(Br)c2cccnc12	108231783	IRFIFGVQHKLMGS-UHFFFAOYSA-N	306.568	2.925	70	30	DFIC	
O=C(c1cccc(Cl)c1)N1CCC[C@H](S(=O)(=O)Cl)C1	97971333	VGGNXGNNQOMLAI-NSHDSACASA-N	322.213	2.513	70	30	DFIC	in-vitro
O=S(=O)(Cl)[C@H]1CCc2cc(Br)ccc2C1	110831763	WDEQWRMNRRDSML-JTQLQIEISA-N	309.612	2.875	70	30	DFIC	in-vitro
O=S(=O)(Cl)N=[S@](=O)(c1ccccc1)C(F)(F)F	325416124	VLLRMEJYXYHQGO-INIZCTEOSA-N	307.702	2.517	70	30	DFIC	
CC(C)(C)OC(=O)NCc1cccc(S(=O)(=O)Cl)c1	390787746	ZHZTYLZUHTZGAM-UHFFFAOYSA-N	305.783	2.639	70	30	DFIC	
CC(=O)Nc1cc(F)c(S(=O)(=O)Cl)c(F)c1Cl	100640962	ZNSQZDSCUYBWAH-UHFFFAOYSA-N	304.101	2.504	70	30	DFIC	in-vitro
COCCOc1c(Cl)cc(S(=O)(=O)Cl)cc1Cl	102959082	UULQBLQKMWWWQO-UHFFFAOYSA-N	319.593	2.946	70	30	DFIC	in-vitro
COc1ccc(S(=O)(=O)Cl)c(NC(=O)C(C)(C)C)c1	100467350	ZPANMRQWSLLKEL-UHFFFAOYSA-N	305.783	2.607	70	30	DFIC	in-vitro
O=S(=O)(Cl)C1=Cc2cc(Br)ccc2OC1	100645368	CPNDFGDTQITCDB-UHFFFAOYSA-N	309.568	2.751	70	30	DFIC	in-vitro
O=S(=O)(OCC(F)(F)c1ccc(F)cc1)C(F)(F)F	675049943	BJSLDFZGNNHORG-UHFFFAOYSA-N	308.199	2.784	70	30	DFIC	
O=S(=O)(Cl)[C@@H]1CCc2cc(Br)ccc2C1	110831766	WDEQWRMNRRDSML-SNVBAGLBSA-N	309.612	2.875	70	30	DFIC	in-vitro
O=S(=O)(Cl)c1cnc2c(Br)csc2c1	307218089	VHBORNQTBVSNHT-UHFFFAOYSA-N	312.597	2.986	70	30	DFIC	
Cc1nn(-c2ccccc2)c2ncc(S(=O)(=O)Cl)cc12	299805238	DVIFUBNCZGWRES-UHFFFAOYSA-N	307.762	2.656	70	30	DFIC	
COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)Cl	59221914	CSHBGJPMGIOCJX-UHFFFAOYSA-N	303.550	2.708	70	30	DFIC	in-vitro
Cn1cc(S(=O)(=O)Cl)c2ccc(Br)cc21	757136663	OEXBRLXUFWTBKF-UHFFFAOYSA-N	308.584	2.868	70	30	DFIC	
CC(C)(C)OC(=O)N1CCC[C@H](CS(=O)(=O)Cl)CC1	407985981	WILWNVQOKSGXME-JTQLQIEISA-N	311.831	2.592	70	30	DFIC	
O=S(=O)(Cl)c1cc(Br)cc2cccnc12	100585934	GKHOYDOQDYWDGB-UHFFFAOYSA-N	306.568	2.925	70	30	DFIC	
O=S(=O)(Cl)c1cc(Br)cc2c1OCCC2	575473637	NCAYBDOBVIODAN-UHFFFAOYSA-N	311.584	2.702	70	30	DFIC	
O=S(=O)(Cl)c1ccc(-c2noc(C(F)(F)F)n2)cc1	950757201	GTUBHECEUPLPMS-UHFFFAOYSA-N	312.656	2.683	70	30	DFIC