smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)O[C@H]2O[C@H]([C@H](O)C[NH2+][C@@H]3C[C@H]([NH2+]C[C@H](O)[C@H]4O[C@@H]5OC(C)(C)O[C@@H]5[C@H]4N=[N+]=[N-])[C@@H](O)[C@H](O)[C@H]3O)[C@H](N=[N+]=[N-])[C@H]2O1	ZINC000261493244	572112048	/nfs/dbraw/zinc/11/20/48/572112048.db2.gz	JRFVGNKTIBZRKF-GHJIPYJDSA-N	2	2	616.629	-1.778	50	10		KACALP
CC1(C)O[C@H]2O[C@H]([C@H](O)C[NH2+][C@@H]3C[C@H]([NH2+]C[C@@H](O)[C@H]4O[C@@H]5OC(C)(C)O[C@@H]5[C@H]4N=[N+]=[N-])[C@@H](O)[C@H](O)[C@H]3O)[C@H](N=[N+]=[N-])[C@H]2O1	ZINC000261493245	572112027	/nfs/dbraw/zinc/11/20/27/572112027.db2.gz	JRFVGNKTIBZRKF-PXLRTUTLSA-N	2	2	616.629	-1.778	50	10		KACALP
CC1(C)O[C@H]2O[C@H]([C@@H](O)C[NH2+][C@@H]3C[C@H]([NH2+]C[C@H](O)[C@H]4O[C@@H]5OC(C)(C)O[C@@H]5[C@H]4N=[N+]=[N-])[C@@H](O)[C@H](O)[C@H]3O)[C@H](N=[N+]=[N-])[C@H]2O1	ZINC000261493246	572111942	/nfs/dbraw/zinc/11/19/42/572111942.db2.gz	JRFVGNKTIBZRKF-XHIJABRBSA-N	2	2	616.629	-1.778	50	10		KACALP
CC1(C)O[C@H]2O[C@H]([C@H](O)C[NH2+][C@H]3C[C@@H]([NH2+]C[C@H](O)[C@H]4O[C@@H]5OC(C)(C)O[C@@H]5[C@H]4N=[N+]=[N-])[C@H](O)[C@@H](O)[C@@H]3O)[C@H](N=[N+]=[N-])[C@H]2O1	ZINC000261493247	572111960	/nfs/dbraw/zinc/11/19/60/572111960.db2.gz	JRFVGNKTIBZRKF-ZPKFQEPMSA-N	2	2	616.629	-1.778	50	10		KACALP