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[C@@H](C)[N+]1(C)N	1564257	571775930	/nfs/dbraw/zinc/77/59/30/571775930.db2.gz	AYLKDTTYJCRWME-HTQZYQBOSA-N	1	3	143.254	1.268	40	5		ADBBHO
C[C@H]1CCC[C@H](C)[N+]1(C)N	1564258	571775941	/nfs/dbraw/zinc/77/59/41/571775941.db2.gz	AYLKDTTYJCRWME-YUMQZZPRSA-N	1	3	143.254	1.268	40	5		ADBBHO
C[N+](C)(C)CCN1C[C@@H]2CC[C@H]2C1	1694701	342959658	/nfs/dbraw/zinc/95/96/58/342959658.db2.gz	ACRTVKJCDLGDPJ-QWRGUYRKSA-N	1	3	183.319	1.034	40	5		ADBBHO
CCCC[N+](C)(N)CCCC	1670599	342956002	/nfs/dbraw/zinc/95/60/02/342956002.db2.gz	VDYNHOUHKQHMNK-UHFFFAOYSA-N	1	3	159.297	1.907	40	5		ADBBHO
CCC[N+](C)(N)CCC	1670598	167096443	/nfs/dbraw/zinc/09/64/43/167096443.db2.gz	QHZJVRGFDCHHRV-UHFFFAOYSA-N	1	3	131.243	1.127	40	5		ADBBHO
CN[C@@H]1CCCC[C@@H]1[N+](C)(C)C	5104890	168040208	/nfs/dbraw/zinc/04/02/08/168040208.db2.gz	DQJYWIGBEKBOOU-ZJUUUORDSA-N	1	3	171.308	1.223	40	5		ADBBHO
CN[C@@H]1CCCC[C@H]1[N+](C)(C)C	5104892	168041480	/nfs/dbraw/zinc/04/14/80/168041480.db2.gz	DQJYWIGBEKBOOU-NXEZZACHSA-N	1	3	171.308	1.223	40	5		ADBBHO
CN[C@H]1CCCC[C@@H]1[N+](C)(C)C	5104891	168055094	/nfs/dbraw/zinc/05/50/94/168055094.db2.gz	DQJYWIGBEKBOOU-UWVGGRQHSA-N	1	3	171.308	1.223	40	5		ADBBHO
CN[C@H]1CCCC[C@H]1[N+](C)(C)C	5104893	168057938	/nfs/dbraw/zinc/05/79/38/168057938.db2.gz	DQJYWIGBEKBOOU-VHSXEESVSA-N	1	3	171.308	1.223	40	5		ADBBHO
C[N+](C)(C)CCN1C[C@H]2CC[C@H]2C1	1694699	342959695	/nfs/dbraw/zinc/95/96/95/342959695.db2.gz	ACRTVKJCDLGDPJ-PHIMTYICSA-N	1	3	183.319	1.034	40	5		ADBBHO
C[N+](C)(C)CCN1C[C@H]2CC[C@@H]2C1	1694700	342959699	/nfs/dbraw/zinc/95/96/99/342959699.db2.gz	ACRTVKJCDLGDPJ-GHMZBOCLSA-N	1	3	183.319	1.034	40	5		ADBBHO
C[C@H]1CCC[C@@H](C)[N+]1(C)N	17104962	343045939	/nfs/dbraw/zinc/04/59/39/343045939.db2.gz	AYLKDTTYJCRWME-JWHQNHQBSA-N	1	3	143.254	1.268	40	5		ADBBHO