smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+](C)CC[NH+]=C1CC(C)(C)c2cc(Cl)ccc2N1	ZINC000096908096	185128389	/nfs/dbraw/zinc/12/83/89/185128389.db2.gz	QUOHZMPLEAMKNV-UHFFFAOYSA-N	2	2	279.815	3.393	1	30		CGEFLP
CCCCCCCCCCCC[NH2+]C[C@H]([NH3+])CC[NH3+]	ZINC000043335327	175011082	/nfs/dbraw/zinc/01/10/82/175011082.db2.gz	CAJDFPMKGMISQB-MRXNPFEDSA-N	3	2	271.493	3.173	1	30		CGEFLP
Cc1cc(NC(Nc2nccs2)=[NH+]C(C)(C)C)cc[nH+]1	ZINC000005419669	170097139	/nfs/dbraw/zinc/09/71/39/170097139.db2.gz	ZXPAEVDDRPLXIK-UHFFFAOYSA-N	2	2	289.408	3.334	1	30		CGEFLP
CCCCCCCCCCCC[NH2+]C[C@@H]([NH3+])CC[NH3+]	ZINC000043335329	175011037	/nfs/dbraw/zinc/01/10/37/175011037.db2.gz	CAJDFPMKGMISQB-INIZCTEOSA-N	3	2	271.493	3.173	1	30		CGEFLP