smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)(C)[PH+](C[PH+](C(C)(C)C)C(C)(C)C)C(C)(C)C	ZINC000002572416	563309786	/nfs/dbraw/zinc/30/97/86/563309786.db2.gz	WBMJFMFJCWPAIT-UHFFFAOYSA-N	2	0	304.439	7.102	40	0		DKABRP
CC(C)(C)[PH+](CC[PH+](C(C)(C)C)C(C)(C)C)C(C)(C)C	ZINC000002572417	563309777	/nfs/dbraw/zinc/30/97/77/563309777.db2.gz	MWVXFEZPEPOQRE-UHFFFAOYSA-N	2	0	318.466	7.144	40	0		DKABRP
C(CCCCC[NH+]1CCCCC1)CCCC[NH+]1CCCCC1	ZINC000005566875	181258026	/nfs/dbraw/zinc/25/80/26/181258026.db2.gz	GDQWFWJIDPRNOD-UHFFFAOYSA-N	2	0	308.554	5.079	40	0		DKABRP
C[NH+](CCC[N@@H+](C)CCC1CCCCC1)CCC1CCCCC1	ZINC000005699200	181274347	/nfs/dbraw/zinc/27/43/47/181274347.db2.gz	ZZNJEMPUFRGQTM-UHFFFAOYSA-N	2	0	322.581	5.181	40	0		DKABRP
CCCCN(CCCC)C[C@@H](CC)[NH+](CCCC)CCCC	ZINC000022862598	182337719	/nfs/dbraw/zinc/33/77/19/182337719.db2.gz	QTRQUZKXZCGXTH-HXUWFJFHSA-N	2	0	312.586	5.569	40	0		DKABRP
CCCCN(CCCC)C[C@H](CC)[NH+](CCCC)CCCC	ZINC000022863442	182337861	/nfs/dbraw/zinc/33/78/61/182337861.db2.gz	QTRQUZKXZCGXTH-FQEVSTJZSA-N	2	0	312.586	5.569	40	0		DKABRP
C(C[NH2+]C1CCCCC1)C[NH2+][C@H]1CCCCC1=C1CCCCC1	ZINC000255189046	202908939	/nfs/dbraw/zinc/90/89/39/202908939.db2.gz	NIWOIGCKRQIPRE-NRFANRHFSA-N	2	0	318.549	5.092	40	0		DKABRP
C(C[NH2+]C1CCCCC1)C[NH2+][C@@H]1CCCCC1=C1CCCCC1	ZINC000255189047	563925938	/nfs/dbraw/zinc/92/59/38/563925938.db2.gz	NIWOIGCKRQIPRE-OAQYLSRUSA-N	2	0	318.549	5.092	40	0		DKABRP