smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccc([N+](C)(C)C)cc1	ZINC000002275313	717094517	/nfs/dbraw/zinc/09/45/17/717094517.db2.gz	YWUJQRAAFMZDKZ-SFHVURJKSA-N	1	0	352.458	3.334	50	50		FGGARO
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccc([N+](C)(C)C)cc1	ZINC000002275314	717094470	/nfs/dbraw/zinc/09/44/70/717094470.db2.gz	YWUJQRAAFMZDKZ-GOSISDBHSA-N	1	0	352.458	3.334	50	50		FGGARO
C/C=C1\C[N@+]2(CCC)CC[C@]34c5cccc(O)c5NC3=C(C=O)[C@H]1C[C@@H]42	ZINC000252441021	717165411	/nfs/dbraw/zinc/16/54/11/717165411.db2.gz	BDPFMCBRYUSSOJ-DIDOZFIKSA-O	1	0	351.470	3.487	50	50		FGGARO
C/C=C1\C[N@+]2(CCC)CC[C@@]34c5cccc(O)c5NC3=C(C=O)[C@H]1C[C@@H]42	ZINC000252460043	717165382	/nfs/dbraw/zinc/16/53/82/717165382.db2.gz	BDPFMCBRYUSSOJ-IMDYZKOTSA-O	1	0	351.470	3.487	50	50		FGGARO
C/C=C1\C[N@@+]2(CCC)CC[C@]34c5cccc(O)c5NC3=C(C=O)[C@H]1C[C@@H]42	ZINC000252441022	717165430	/nfs/dbraw/zinc/16/54/30/717165430.db2.gz	BDPFMCBRYUSSOJ-IRMKIPKASA-O	1	0	351.470	3.487	50	50		FGGARO
C/C=C1/C[N@+]2(CCC)CC[C@]34c5cccc(O)c5NC3=C(C=O)[C@H]1C[C@@H]42	ZINC000254478517	717170632	/nfs/dbraw/zinc/17/06/32/717170632.db2.gz	BDPFMCBRYUSSOJ-WKSFFAIESA-O	1	0	351.470	3.487	50	50		FGGARO