smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
COc1cc(Cc2nc3cccc(S(N)(=O)=O)c3[nH]2)cc(S(=O)(=O)Cl)c1OC	586925804	WIHNYSNEYQYGHW-UHFFFAOYSA-N	445.906	1.746	70	1	IDIF	
O=S(=O)(CS(=O)(=O)C(F)(F)F)c1ccc(OS(=O)(=O)C(F)(F)F)cc1	43640848	NVCNCXYAOBRSCC-UHFFFAOYSA-N	436.329	1.581	70	1	IDIF	
CC(C)(C)OC(=O)N1CCN(c2cc3c(cc2F)c(=O)c2c(n3C3CC3)COB2O)CC1	205386700	YNIWASMFCZCJNL-UHFFFAOYSA-N	443.284	1.750	70	1	IDIF	
CC1(C)N=C(N)N=C(N)N1c1cccc(CNC(=O)Nc2cccc(S(=O)(=O)F)c2)c1	43307386	ZGPVLMRPVGYNPN-UHFFFAOYSA-N	447.496	1.852	70	1	IDIF	
CC(C)C[C@@H](CS(=O)(=O)F)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1	95576474	QFZMNRFPELMKNA-IRXDYDNUSA-N	436.509	1.648	70	1	IDIF	
O=C1OCc2cc(CCC3(O)CCN(C(=O)Cc4ccc(-n5cnnn5)cc4)CC3)ccc21	218511366	LUSGOTJDJQEKNQ-UHFFFAOYSA-N	447.495	1.862	70	1	IDIF	
CC1(C)N=C(N)N=C(N)N1c1ccc(CNC(=O)Nc2ccc(S(=O)(=O)F)cc2)cc1	43833424	UHCMTFBGBHQXSX-UHFFFAOYSA-N	447.496	1.852	70	1	IDIF	
CCCn1c(=O)c2nc(NC(=O)c3ccc(S(=O)(=O)F)cc3)[nH]c2n(CCC)c1=O	100739107	MJXSWDVTVSUXNH-UHFFFAOYSA-N	437.453	1.617	70	1	IDIF	
Nc1nc2ncn(Cc3ccc(NC(=O)c4ccc(S(=O)(=O)F)cc4)cc3)c2c(=O)[nH]1	43361934	NXJZXCIHJUJWEF-UHFFFAOYSA-N	442.432	1.661	70	1	IDIF	
CC1(C)N=C(N)N=C(N)N1c1cccc(OCCOc2ccc(S(=O)(=O)F)cc2)c1	43834639	FUKSMQMDIHARCM-UHFFFAOYSA-N	435.481	1.988	70	1	IDIF	
CC1(C)N=C(N)N=C(N)N1c1ccc(CCNC(=O)c2ccc(S(=O)(=O)F)cc2)cc1	43307961	SDTGHBWKUJWQSJ-UHFFFAOYSA-N	446.508	1.503	70	1	IDIF	
Nc1nc2ncn(Cc3cccc(NC(=O)c4cccc(S(=O)(=O)F)c4)c3)c2c(=O)[nH]1	43356689	JFMMOXZUHXDFEQ-UHFFFAOYSA-N	442.432	1.661	70	1	IDIF	
CC1(C)N=C(N)N=C(N)N1c1ccc(CC(=O)Nc2ccc(S(=O)(=O)F)cc2)cc1	43307536	AMHWMJVWJUIWRK-UHFFFAOYSA-N	432.481	1.712	70	1	IDIF	
CCCn1c(=O)c2nc(NC(=O)c3cccc(S(=O)(=O)F)c3)[nH]c2n(CCC)c1=O	100739146	ZPVVBXADJGZUBV-UHFFFAOYSA-N	437.453	1.617	70	1	IDIF	
Nc1nc2ncn(Cc3cccc(NC(=O)c4ccc(S(=O)(=O)F)cc4)c3)c2c(=O)[nH]1	43871933	ANNAZKAVCPRJPJ-UHFFFAOYSA-N	442.432	1.661	70	1	IDIF	
CCN1C(=O)NC(=O)[C@@]12CC[C@@]1(O)[C@H]3Cc4ccc(O)cc4[C@@]1(CCN3CC1CC1)C2	218582711	HOXVEQPEYBUSKK-OUJCMCIWSA-N	425.529	1.896	70	1	IDIF	
CC1(C)N=C(N)N=C(N)N1c1ccc(CNC(=O)Nc2cccc(S(=O)(=O)F)c2)cc1	43307582	OIAACAMEFKUWTA-UHFFFAOYSA-N	447.496	1.852	70	1	IDIF	
Nc1nc2ncn(Cc3ccc(NC(=O)c4cccc(S(=O)(=O)F)c4)cc3)c2c(=O)[nH]1	43361930	CGYMUMSUMSNDJV-UHFFFAOYSA-N	442.432	1.661	70	1	IDIF	
COc1cc(Cc2nc3ccc(S(N)(=O)=O)cc3[nH]2)cc(S(=O)(=O)Cl)c1OC	586924319	AKYBZGADSRMOEM-UHFFFAOYSA-N	445.906	1.746	70	1	IDIF	
CC1(C)N=C(N)N=C(N)N1c1cccc(OCC(=O)Nc2ccc(S(=O)(=O)F)cc2)c1	43307475	ZVAJQUGYIWRZKN-UHFFFAOYSA-N	448.480	1.548	70	1	IDIF