smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
Cc1nc(N)cc(OC2CCN(C(=O)c3ccc(S(=O)(=O)F)cc3)CC2)n1	1857761526	CVUGMFABZAFDNS-UHFFFAOYSA-N	394.428	1.709	70	1	GDIF	
CCCC[C@H]1OB(O)C[C@H]2C1=C(COC)Cn1c(=O)n(-c3ccccc3)c(=O)n12	197102244	CLEIYVOPWCTZCC-DLBZAZTESA-N	399.256	1.368	70	1	GDIF	
COc1cc(Cc2nc3cnnc(O)c3[nH]2)cc(S(=O)(=O)Cl)c1OC	586924775	IPQNJYRIFRFGGD-UHFFFAOYSA-N	384.801	1.594	70	1	GDIF	
COc1cc([C@@H](O)[C@H](CO)Oc2ccc(C(=O)CCO)cc2OC)ccc1O	216630099	IKJHTJHAKMULPY-VQTJNVASSA-N	392.404	1.448	70	1	GDIF	
COc1ccc2c(c1)[C@]13CCN(CC4CC4)[C@H](C2)[C@]1(O)CC[C@@]1(CNC(=O)N1)C3	218570949	LNEAIVXOJNEWAR-CWKRKGSWSA-N	397.519	1.940	70	1	GDIF	
N=c1cc(OC2CCN(C(=O)c3ccc(S(=O)(=O)F)cc3)CC2)cc[nH]1	1857639136	JZCRDRWTEAZDJD-UHFFFAOYSA-N	379.413	1.836	70	1	GDIF	
COc1cc(Cc2nc3c(N)ncnc3[nH]2)cc(S(=O)(=O)Cl)c1OC	586925978	ZWXALTXZRXCIOO-UHFFFAOYSA-N	383.817	1.471	70	1	GDIF	
O=C1NC(=O)[C@@]2(CC[C@@]3(O)[C@H]4Cc5ccc(O)cc5[C@@]3(CCN4CC3CC3)C2)N1	218569082	DHSMVZLJJOUQPJ-HLRQEUIKSA-N	397.475	1.164	70	1	GDIF	
O=C(O)Cc1cc2c(O)nc(O)nc2nc1-c1ccc(S(=O)(=O)Cl)cc1	587562692	IQJBKGLWXARPLX-UHFFFAOYSA-N	395.780	1.658	70	1	GDIF	
COc1cc(Cc2nc3c(O)nc(N)nc3[nH]2)cc(S(=O)(=O)Cl)c1OC	586924778	ISAGHPGQLLLFFT-UHFFFAOYSA-N	399.816	1.176	70	1	GDIF	
COc1cc(C(=O)c2ccn(-c3ccc4c(c3)B(O)OC4)c2)cc(OC)c1OC	221694599	VAIXYTHIPWSHBZ-UHFFFAOYSA-N	393.204	1.952	70	1	GDIF	
CC(C)c1nn(C)c2c1[C@]1(NCC2)C(=O)Nc2ccc(S(=O)(=O)Cl)cc21	962918501	JGRRKZZPMBLOGK-KRWDZBQOSA-N	394.884	1.812	70	1	GDIF	
COc1cc(Cc2nc3ccnc(N)c3[nH]2)cc(S(=O)(=O)Cl)c1OC	586925339	OOPWFELZITWROS-UHFFFAOYSA-N	382.829	2.076	70	1	GDIF	
COc1cc(Cc2nc3cc(N)ncc3[nH]2)cc(S(=O)(=O)Cl)c1OC	586925075	LKXDRVHKFWJELD-UHFFFAOYSA-N	382.829	2.076	70	1	GDIF	
COc1cc(Cc2nc3c(O)ncnc3[nH]2)cc(S(=O)(=O)Cl)c1OC	586925539	SPUXNGNHUAFKRZ-UHFFFAOYSA-N	384.801	1.594	70	1	GDIF	
CC(C)c1nn(C)c2c1[C@@]1(NCC2)C(=O)Nc2ccc(S(=O)(=O)Cl)cc21	962918504	JGRRKZZPMBLOGK-QGZVFWFLSA-N	394.884	1.812	70	1	GDIF	
N[C@@H](CC(=O)N1CC(=O)Nc2nccnc2C1)[C@H]1CCc2cc(F)c(F)cc21	218043198	IYILRUONGQGIJU-NHYWBVRUSA-N	387.390	1.483	70	1	GDIF	
COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2c(O)nc(N)nc2[nH]1	586924737	IAWHTAAPYPUHGK-UHFFFAOYSA-N	390.208	1.897	70	1	GDIF	
Cc1nc(N)c2cnn(CCCNC(=O)c3ccc(S(=O)(=O)F)cc3)c2n1	1857763603	CFIJILHCAGJIIH-UHFFFAOYSA-N	392.416	1.195	70	1	GDIF	
O=C1NC[C@@]2(CC[C@@]3(O)[C@H]4Cc5ccc(O)cc5[C@@]3(CCN4CC3CC3)C2)N1	218566987	DUGGIXUFKBZLGC-FVTFTPSCSA-N	383.492	1.637	70	1	GDIF	
CCOC(=O)c1cnc(-c2cc(S(=O)(=O)Cl)ccc2OCC)[nH]c1=O	169335214	KOERSZIYHXFTRV-UHFFFAOYSA-N	386.813	1.940	70	1	GDIF	
COc1cc(Cc2nc3c[nH]c(=N)[nH]c-3n2)cc(S(=O)(=O)Cl)c1OC	586924763	IKTIBRPNDNFHHA-UHFFFAOYSA-N	383.817	1.253	70	1	GDIF