smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
Cn1cc(S(=O)(=O)F)c(=O)n(C)c1=O	238857165	YERNVZKYZASINV-UHFFFAOYSA-N	222.197	-1.258	70	50	BAIA	
Cn1cc(N2CCN(C(=O)CN)CC2=O)cn1	161023525	KGPCDXYCDSFBBU-UHFFFAOYSA-N	237.263	-1.446	70	50	BAIA	
O=C(CO)N[C@@H]1CCOC[C@H]1OCCO	218243357	BLCFDMQVAMYOAV-HTQZYQBOSA-N	219.237	-1.739	70	50	BAIA	
O=c1[nH]cc(S(=O)(=O)Cl)c(=O)[nH]1	59681301	FQHNJCWWBKYCJW-UHFFFAOYSA-N	210.598	-1.009	70	50	BAIA	biogenic,in-vitro
O=C1NC(=O)[C@H](CCS(=O)(=O)F)N1	307689380	NDFRMHWJIOBACQ-VKHMYHEASA-N	210.186	-1.116	70	50	BAIA	
CN(C)CCO[C@@H]1COCC[C@H]1NC(=O)CO	218743468	WDZOCULMWPOBPQ-NXEZZACHSA-N	246.307	-1.169	70	50	BAIA	
Cn1nc2n(c1=O)CCN(S(=O)(=O)F)C2	1875375165	STLWEDDUDIUKMG-UHFFFAOYSA-N	236.228	-1.388	70	50	BAIA	
O=C1NC(=O)[C@@H](CCS(=O)(=O)F)N1	307689379	NDFRMHWJIOBACQ-GSVOUGTGSA-N	210.186	-1.116	70	50	BAIA	
COC[C@H]1[C@H]2OCC[C@H]2[C@H]1NC(CO)CO	218404185	PDXASZNACQPETK-ZDCRXTMVSA-N	231.292	-1.021	70	50	BAIA