smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(=O)c1c(O)c2c(C)cc(=O)oc2c2c1OC(=O)C[C@@H]2c1cccc(OCC(N)=O)c1	ZINC000217977291	569455577	/nfs/dbraw/zinc/45/55/77/569455577.db2.gz	ZXXFSZFIBNSSGV-CQSZACIVSA-N	0	1	437.404	2.315	50	70	biogenic	IEIAMN
O=C(CC[C@@H]1NC(=O)N(Cc2ccccc2)C1=O)Nc1nnc(CCc2ccccc2)[nH]1	ZINC000218386500	557196862	/nfs/dbraw/zinc/19/68/62/557196862.db2.gz	SHMWUKJIHRGVDP-SFHVURJKSA-N	0	1	432.484	2.429	50	70		IEIAMN
O=C(CC[C@@H]1NC(=O)N(Cc2ccccc2)C1=O)Nc1nc(CCc2ccccc2)n[nH]1	ZINC000218386500	557196864	/nfs/dbraw/zinc/19/68/64/557196864.db2.gz	SHMWUKJIHRGVDP-SFHVURJKSA-N	0	1	432.484	2.429	50	70		IEIAMN
O=C(C[C@@H]1NC(=O)c2ccccc2NC1=O)Nc1nnc(CCc2c[nH]c3ccccc23)[nH]1	ZINC000217828526	557174360	/nfs/dbraw/zinc/17/43/60/557174360.db2.gz	URNVCQHOXBBQFU-SFHVURJKSA-N	0	1	443.467	2.151	50	70	biogenic	IEIAMN
O=C(C[C@@H]1NC(=O)c2ccccc2NC1=O)Nc1nc(CCc2c[nH]c3ccccc23)n[nH]1	ZINC000217828526	557174364	/nfs/dbraw/zinc/17/43/64/557174364.db2.gz	URNVCQHOXBBQFU-SFHVURJKSA-N	0	1	443.467	2.151	50	70	biogenic	IEIAMN
CC(=O)c1c(O)c2c(C)cc(=O)oc2c2c1OC(=O)C[C@H]2c1cccc(OCC(N)=O)c1	ZINC000217977229	569455557	/nfs/dbraw/zinc/45/55/57/569455557.db2.gz	ZXXFSZFIBNSSGV-AWEZNQCLSA-N	0	1	437.404	2.315	50	70	biogenic	IEIAMN
COc1cc(-c2cc(C(=O)N3CC(Oc4cc(C)oc(=O)c4)C3)n[nH]2)cc(OC)c1OC	ZINC000217751652	569452627	/nfs/dbraw/zinc/45/26/27/569452627.db2.gz	HQGVTVFILXNHKB-UHFFFAOYSA-N	0	1	441.440	2.268	50	70		IEIAMN
COc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)[C@@H]2CCCN2[C@@]32c3ccccc3NC2=O)cc1OC	ZINC000217723609	557173302	/nfs/dbraw/zinc/17/33/02/557173302.db2.gz	DMYOOPSREMVGOU-XXPWESIGSA-N	0	1	433.464	2.135	50	70		IEIAMN