smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
COC(=O)c1ccc(Oc2ccc3c(c2)COB3O)nc1	195368008	UKFVNANHQNWOPV-UHFFFAOYSA-N	285.064	0.878	70	1	CCIF	
COC(=O)c1cnc(Oc2ccc3c(c2)B(O)OC3)nc1	198022183	VJQXBVIXJBYFJH-UHFFFAOYSA-N	286.052	0.273	70	1	CCIF	
COC(=O)c1cnc(Oc2ccc3c(c2)B(O)OC3)cn1	198022191	DLUORMNCJKKNSB-UHFFFAOYSA-N	286.052	0.273	70	1	CCIF	
O=S(=O)(c1ccccc1)c1ccc2c(c1)B(O)OC2	170140420	MHQWCNVYPLBFEA-UHFFFAOYSA-N	274.106	0.737	70	1	CCIF	
CNC(=O)c1cccn1-c1ccc2c(c1)B(O)OC2	221692841	IDMZUTIBNZQYAO-UHFFFAOYSA-N	256.070	0.055	70	1	CCIF	
COc1ccc2c(c1)[n+]([O-])c(C(=O)N=[N+]=[N-])c(C)[n+]2[O-]	53297694	RUMHIKHLLDKGQQ-UHFFFAOYSA-N	275.224	0.874	70	1	CCIF	
CCNC(=O)c1cccn1-c1ccc2c(c1)B(O)OC2	221692904	ANFKFNLHTPTQET-UHFFFAOYSA-N	270.097	0.445	70	1	CCIF	
COc1ccccc1[B-]1(c2ccccc2OC)NCCO1	170186677	HSRUNCWEVFRTMR-UHFFFAOYSA-N	284.144	0.880	70	1	CCIF	
O=C(On1nnc2ccccc21)c1cc(O)c(O)c(O)c1	64549768	CIEXMTSLXQLIMB-UHFFFAOYSA-N	287.231	0.817	70	1	CCIF	
CCCNC(=O)c1cccn1-c1ccc2c(c1)B(O)OC2	221692694	RRCWTROSCSEENE-UHFFFAOYSA-N	284.124	0.835	70	1	CCIF	
CC(C)(C)NC(=O)CCc1cccc2c1B(O)OC2	204055404	AXCYDZJFZAWIQR-UHFFFAOYSA-N	261.130	0.752	70	1	CCIF	
COc1ccc([B-]2(c3ccc(OC)cc3)NCCO2)cc1	170186661	HWZRCYHWZOMNON-UHFFFAOYSA-N	284.144	0.880	70	1	CCIF	
CC(C)(C)NC(=O)COc1ccc2c(c1)B(O)OC2	195378643	DWYYYSTZMGDIMY-UHFFFAOYSA-N	263.102	0.198	70	1	CCIF