smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
CN1CCc2[nH]nc(C(=O)N[C@H]3[C@H]4CCO[C@H]4[C@@H]3NS(C)(=O)=O)c2C1	218567242	FPNXZLPMXBEOIV-MGNUUCGSSA-N	369.447	-1.168	70	50	FAIA	
CN(C)C(=O)C[C@@H](O)c1cc2n(n1)CCN(Cc1cc(=O)[nH]c(=O)[nH]1)C2	218625099	HQERZKIMBIBYDF-CYBMUJFWSA-N	362.390	-1.213	70	50	FAIA	
Cn1cc(C(=O)N[C@H]2[C@H]3CCO[C@H]3[C@@H]2NS(C)(=O)=O)c(=O)[nH]c1=O	218427124	FSNCVARZFBRTFS-XCWAXFADSA-N	358.376	-2.492	70	50	FAIA	
Cn1c(C(=O)N2CCCn3nc([C@H](O)CO)cc3C2)cc(=O)n(C)c1=O	217191011	KXULGKUGYNAOLU-CYBMUJFWSA-N	363.374	-1.648	70	50	FAIA	
CS(=O)(=O)N1CCN(C(=O)Cc2cccnc2)[C@@H]2CS(=O)(=O)C[C@@H]21	216948156	ZSYGFFLSNZRJLM-OLZOCXBDSA-N	373.456	-1.107	70	50	FAIA	
Cn1c(N2CCn3nc([C@H](O)CO)cc3C2)nc2c1c(=O)[nH]c(=O)n2C	217814935	SVOHTLCZECCKHU-SNVBAGLBSA-N	361.362	-1.797	70	50	FAIA	
Cn1c(C(=O)N2CCCn3nc([C@@H](O)CO)cc3C2)cc(=O)n(C)c1=O	217191004	KXULGKUGYNAOLU-ZDUSSCGKSA-N	363.374	-1.648	70	50	FAIA	
CS(=O)(=O)N1CCC[C@H]1C(=O)N1CCN(CCn2cncn2)CC1	218129807	JSAIGJAZRBMSJN-ZDUSSCGKSA-N	356.452	-1.154	70	50	FAIA	
NC(=O)COc1ccc(S(=O)(=O)N[C@@H]2CCOC[C@H]2OCCO)cc1	218272422	OMNHFIXINQPWOZ-ZIAGYGMSSA-N	374.415	-1.005	70	50	FAIA	
Cc1nc2[nH]cc(C(=O)N3CCC4(CC3)N=C(N(C)C)NC4=O)c(=O)n2n1	218064865	DKMWKUWXJQALPN-UHFFFAOYSA-N	372.389	-1.252	70	50	FAIA	
COC[C@H](O)CNS(=O)(=O)c1cccc(C(=O)NCC(=O)N(C)C)c1	217399463	LQSSXSTVPDBQQE-GFCCVEGCSA-N	373.431	-1.210	70	50	FAIA	
Cn1cc(S(=O)(=O)N2CCCn3nc(CO)cc3C2)c(=O)n(C)c1=O	217729739	CBWFZBIOAIKWAK-UHFFFAOYSA-N	369.403	-1.633	70	50	FAIA	
CN(C)C(=O)C[C@H](O)c1cc2n(n1)CCN(Cc1cc(=O)[nH]c(=O)[nH]1)C2	218625182	HQERZKIMBIBYDF-ZDUSSCGKSA-N	362.390	-1.213	70	50	FAIA	
BBBBBBBBBB1C(Cc2ccc(O)cc2)=C1Cc1ccc(O)cc1	195814795	WPEZPBOFHUSRKK-UHFFFAOYSA-N	356.486	-3.292	70	50	FAIA	
COC[C@@H](O)CNS(=O)(=O)c1cccc(C(=O)NCC(=O)N(C)C)c1	217399385	LQSSXSTVPDBQQE-LBPRGKRZSA-N	373.431	-1.210	70	50	FAIA	
NC1CCN(c2nccc(N3CCN[C@@H]4CS(=O)(=O)C[C@@H]43)n2)CC1	216937407	NOAIUZGQDGIDOD-OLZOCXBDSA-N	352.464	-1.021	70	50	FAIA	
CN1CC(=O)N(CC(=O)N2CCCn3nc([C@H](O)CO)cc3C2)C1=O	216998404	SAXHBAFRKKKJJP-GFCCVEGCSA-N	351.363	-1.465	70	50	FAIA	
CN1CC(=O)N(CC(=O)N2CCCn3nc([C@@H](O)CO)cc3C2)C1=O	216998393	SAXHBAFRKKKJJP-LBPRGKRZSA-N	351.363	-1.465	70	50	FAIA	
Cn1c(N2CCn3nc([C@@H](O)CO)cc3C2)nc2c1c(=O)[nH]c(=O)n2C	217814864	SVOHTLCZECCKHU-JTQLQIEISA-N	361.362	-1.797	70	50	FAIA	
COCC(=O)N1CCN(C)C[C@H]1C(=O)NCCSc1nnnn1C	218653759	WKXFQETZNVUTRV-JTQLQIEISA-N	357.440	-1.793	70	50	FAIA	
COCC(=O)N1CCN(C)C[C@@H]1C(=O)NCCSc1nnnn1C	218653690	WKXFQETZNVUTRV-SNVBAGLBSA-N	357.440	-1.793	70	50	FAIA	
Cn1nnc2c(S(=O)(=O)N[C@@H]3COCC[C@@H]3OCC(N)=O)cccc21	218712212	YSAZQCKWCVIRGA-KOLCDFICSA-N	369.403	-1.094	70	50	FAIA