smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C#CC[NH2+][C@@H](Cc1c[nH+]c[nH]1)C(=O)[O-]	5827995	166024275	/nfs/dbraw/zinc/02/42/75/166024275.db2.gz	SVZLFLOVBBGVRX-QMMMGPOBSA-N	1	2	193.206	-0.372	1	30		ABEFLO
C#CC[NH2+][C@@H](Cc1c[nH]c[nH+]1)C(=O)[O-]	5827995	166024277	/nfs/dbraw/zinc/02/42/77/166024277.db2.gz	SVZLFLOVBBGVRX-QMMMGPOBSA-N	1	2	193.206	-0.372	1	30		ABEFLO
C#CC[NH2+][C@H](Cc1c[nH+]c[nH]1)C(=O)[O-]	5828002	166027667	/nfs/dbraw/zinc/02/76/67/166027667.db2.gz	SVZLFLOVBBGVRX-MRVPVSSYSA-N	1	2	193.206	-0.372	1	30		ABEFLO
C#CC[NH2+][C@H](Cc1c[nH]c[nH+]1)C(=O)[O-]	5828002	166027670	/nfs/dbraw/zinc/02/76/70/166027670.db2.gz	SVZLFLOVBBGVRX-MRVPVSSYSA-N	1	2	193.206	-0.372	1	30		ABEFLO
[NH2+]=C(NO)NN=Cc1ccco1	71333531	169132891	/nfs/dbraw/zinc/13/28/91/169132891.db2.gz	WIUGRDSLULCDKV-XBXARRHUSA-N	1	2	168.156	-0.093	1	30		ABEFLO