smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C#[N+]CC1CCC(C#N)CC1	259566289	573764033	/nfs/dbraw/zinc/76/40/33/573764033.db2.gz	IUTUVFOXKILHRJ-UHFFFAOYSA-N	1	0	148.209	2.236	10	50		AEGERO
C[N+](C)(C)CCCCCCl	34077390	717123933	/nfs/dbraw/zinc/12/39/33/717123933.db2.gz	AEGYJAMFWSNFPB-UHFFFAOYSA-N	1	0	164.700	2.102	10	50		AEGERO
CC[N+](CC)(CC)CCl	34087537	717124023	/nfs/dbraw/zinc/12/40/23/717124023.db2.gz	QBOWHDXYARGWBT-UHFFFAOYSA-N	1	0	150.673	2.059	10	50		AEGERO
C[N+](C)(C)CCCCCCCl	113911849	717149590	/nfs/dbraw/zinc/14/95/90/717149590.db2.gz	YGMFZXFNVXZCKN-UHFFFAOYSA-N	1	0	178.727	2.492	10	50		AEGERO
CC[N+]1(CCl)CCCCC1	196763039	717158238	/nfs/dbraw/zinc/15/82/38/717158238.db2.gz	WTFQNYJGNPFAOS-UHFFFAOYSA-N	1	0	162.684	2.203	10	50		AEGERO
CC(C)=CC[N+](C)(C)CCCl	217833907	717161460	/nfs/dbraw/zinc/16/14/60/717161460.db2.gz	MSQWTJMGFJYEFW-UHFFFAOYSA-N	1	0	176.711	2.268	10	50		AEGERO
C[N+](C)(C)C[C@@H]1CCC[C@@H]1Cl	238484930	717161870	/nfs/dbraw/zinc/16/18/70/717161870.db2.gz	AACWMJQGYYEAAN-IUCAKERBSA-N	1	0	176.711	2.100	10	50		AEGERO
C[N+](C)(C)C[C@@H]1CCC[C@H]1Cl	238484947	717161874	/nfs/dbraw/zinc/16/18/74/717161874.db2.gz	AACWMJQGYYEAAN-DTWKUNHWSA-N	1	0	176.711	2.100	10	50		AEGERO
C[N+](C)(C)C[C@H]1CCC[C@@H]1Cl	238485133	717161892	/nfs/dbraw/zinc/16/18/92/717161892.db2.gz	AACWMJQGYYEAAN-BDAKNGLRSA-N	1	0	176.711	2.100	10	50		AEGERO
C[N+](C)(C)C[C@H]1CCC[C@H]1Cl	238485153	717161907	/nfs/dbraw/zinc/16/19/07/717161907.db2.gz	AACWMJQGYYEAAN-RKDXNWHRSA-N	1	0	176.711	2.100	10	50		AEGERO
C#[N+]CC1CCC(C(=O)OCC)CC1	259495361	573538064	/nfs/dbraw/zinc/53/80/64/573538064.db2.gz	AAXWPYORKZDSLG-UHFFFAOYSA-N	1	0	195.262	2.275	10	50		AEGERO
C[NH+](C)C1CCC(Cl)CC1	715254004	926122327	/nfs/dbraw/zinc/12/23/27/926122327.db2.gz	LFBZLKGOXUQSER-UHFFFAOYSA-N	1	0	161.676	2.098	10	50		AEGERO