smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
[N-]=[N+]=NCCOCCOCCOCCOCCNC(=O)COc1cccc2c1C(=O)N([C@H]1CCC(=O)NC1=O)C2=O	1857791895	XECAZVOTJVYNEM-SFHVURJKSA-N	576.563	-0.041	10	20	KBCD	
Cc1cc(O)c2c(c1)C(=O)c1cccc(O[C@@H]3O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]3O)c1C2=O	85490536	JTBHLAGLMHJJIX-LHNXKRSWSA-N	502.428	-0.320	10	20	KBCD	biogenic,in-vitro
C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)NCCCC[C@H](NC(=O)[C@@H]1Cc2cc(O)c(O)cc2C(C)(C)N1)C(=O)O	2048541433	HCQSIGZMBBOVBZ-NHKCCNDQSA-N	661.801	-0.426	10	20	KBCD	
C[C@H](NC(=O)CCOCCOCCOCCOCCOCCN=[N+]=[N-])C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)Nc1ccc(CO)cc1	1857791853	FYXWRYWMFYMQKH-HWBMXIPRSA-N	697.743	-0.130	10	20	KBCD	
[N-]=[N+]=NCCOCCOCCOCCOCCNC(=O)COc1cccc2c1C(=O)N([C@@H]1CCC(=O)NC1=O)C2=O	1857791894	XECAZVOTJVYNEM-GOSISDBHSA-N	576.563	-0.041	10	20	KBCD