smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@H]1CCC[N@H+](C[C@@]2(C)CC[NH2+]C2)CC1	ZINC000216861316	177100042	/nfs/dbraw/zinc/10/00/42/177100042.db2.gz	RBZPORVMSMJMKQ-STQMWFEESA-N	2	0	210.365	2.108	10	70		BEIERP
C[NH+]([Si](C)(C)C)[Si](C)(C)[N@H+](C)[SiH](C)C	ZINC000206570968	368360687	/nfs/dbraw/zinc/36/06/87/368360687.db2.gz	JKTZJILODCAXCL-UHFFFAOYSA-N	2	0	248.595	2.370	10	70		BEIERP
C[C@@H]1CCC[N@H+](C[C@@]2(C)CC[NH2+]C2)CC1	ZINC000216861292	176099285	/nfs/dbraw/zinc/09/92/85/176099285.db2.gz	RBZPORVMSMJMKQ-OLZOCXBDSA-N	2	0	210.365	2.108	10	70		BEIERP
C([NH2+]C1CC[NH2+]CC1)C1C2CC3CC(C2)CC1C3	ZINC000216710543	345743484	/nfs/dbraw/zinc/74/34/84/345743484.db2.gz	JGUYHWISLRJRMB-UHFFFAOYSA-N	2	0	248.414	2.400	10	70		BEIERP
C([NH2+][C@H]1CC[NH2+]C1)C1C2CC3CC(C2)CC1C3	ZINC000217176673	345744376	/nfs/dbraw/zinc/74/43/76/345744376.db2.gz	UQQQGBMSOURTQS-BPHCLYMKSA-N	2	0	234.387	2.010	10	70		BEIERP
C[C@@H]([NH3+])CC[NH2+]C1C2CC3CC(C2)CC1C3	ZINC000216841210	345744198	/nfs/dbraw/zinc/74/41/98/345744198.db2.gz	ILOLNDOSDJIRSM-UIBFTYAWSA-N	2	0	222.376	2.138	10	70		BEIERP
C([NH2+][C@@H]1CC[NH2+]C1)C1C2CC3CC(C2)CC1C3	ZINC000217176668	345744113	/nfs/dbraw/zinc/74/41/13/345744113.db2.gz	UQQQGBMSOURTQS-DUTNFGBUSA-N	2	0	234.387	2.010	10	70		BEIERP