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)[PH+](c1ccccc1)C(C)C	ZINC000001765041	571783296	/nfs/dbraw/zinc/78/32/96/571783296.db2.gz	AIFSJAIZLCBORN-UHFFFAOYSA-N	1	2	194.258	3.611	10	0		AHAELO
CCCC[N@@H+](CC)c1cccc(C)c1	ZINC000002521513	342973821	/nfs/dbraw/zinc/97/38/21/342973821.db2.gz	RHYNBOJRMMSEJM-UHFFFAOYSA-N	1	2	191.318	3.621	10	0		AHAELO
CCCC[N@H+](CC)c1cccc(C)c1	ZINC000002521513	342973818	/nfs/dbraw/zinc/97/38/18/342973818.db2.gz	RHYNBOJRMMSEJM-UHFFFAOYSA-N	1	2	191.318	3.621	10	0		AHAELO
CCCCc1[nH+]ccc2ccccc21	ZINC000005310325	571838615	/nfs/dbraw/zinc/83/86/15/571838615.db2.gz	KXAVXNWSOPHOON-UHFFFAOYSA-N	1	2	185.270	3.577	10	0		AHAELO
Cc1ccc([NH+](C(C)C)C(C)C)cc1	ZINC000005419794	168820973	/nfs/dbraw/zinc/82/09/73/168820973.db2.gz	YHAUWIDCXVQMPN-UHFFFAOYSA-N	1	2	191.318	3.618	10	0		AHAELO
c1c[nH+]c2c(c1)CCCCCCCC2	ZINC000038642470	171069886	/nfs/dbraw/zinc/06/98/86/171069886.db2.gz	BHNLTTSWHMADPU-UHFFFAOYSA-N	1	2	189.302	3.521	10	0		AHAELO
CC(C)c1cc[nH+]c(C(C)(C)C)c1	ZINC000039369474	571925112	/nfs/dbraw/zinc/92/51/12/571925112.db2.gz	RRXOQGSZUDVUOF-UHFFFAOYSA-N	1	2	177.291	3.503	10	0		AHAELO
CCc1[nH+]c2cc(C)c(C)cc2cc1C	ZINC000039408317	572359998	/nfs/dbraw/zinc/35/99/98/572359998.db2.gz	JHSLZWLUUBMXHS-UHFFFAOYSA-N	1	2	199.297	3.722	10	0		AHAELO
CCc1c[nH+]c2c(c1)[C@@H](C)CC[C@H]2C	ZINC000049806523	572809578	/nfs/dbraw/zinc/80/95/78/572809578.db2.gz	ZLUXECOZOTXHHZ-VHSXEESVSA-N	1	2	189.302	3.645	10	0		AHAELO
CCc1c[nH+]c2c(c1)[C@@H](C)CC[C@@H]2C	ZINC000049806524	572809475	/nfs/dbraw/zinc/80/94/75/572809475.db2.gz	ZLUXECOZOTXHHZ-UWVGGRQHSA-N	1	2	189.302	3.645	10	0		AHAELO
CCc1c[nH+]c2c(c1)[C@H](C)CC[C@H]2C	ZINC000049806525	572809839	/nfs/dbraw/zinc/80/98/39/572809839.db2.gz	ZLUXECOZOTXHHZ-NXEZZACHSA-N	1	2	189.302	3.645	10	0		AHAELO
CCc1c[nH+]c2c(c1)[C@H](C)CC[C@@H]2C	ZINC000049806526	572809905	/nfs/dbraw/zinc/80/99/05/572809905.db2.gz	ZLUXECOZOTXHHZ-ZJUUUORDSA-N	1	2	189.302	3.645	10	0		AHAELO
CC(C)c1c[nH+]c2c(c1)CCC[C@H]2C	ZINC000049806529	572811301	/nfs/dbraw/zinc/81/13/01/572811301.db2.gz	FKVQFCZRGGUSPQ-SNVBAGLBSA-N	1	2	189.302	3.645	10	0		AHAELO
CC(C)c1c[nH+]c2c(c1)CCC[C@@H]2C	ZINC000049806530	572809655	/nfs/dbraw/zinc/80/96/55/572809655.db2.gz	FKVQFCZRGGUSPQ-JTQLQIEISA-N	1	2	189.302	3.645	10	0		AHAELO
Cc1cc(C)c2c(c1)[nH+]ccc2C(C)C	ZINC000077255202	572842975	/nfs/dbraw/zinc/84/29/75/572842975.db2.gz	PUOCFQKBVZKAGE-UHFFFAOYSA-N	1	2	199.297	3.975	10	0		AHAELO
Cc1cc(C)c2cccc(C(C)C)c2[nH+]1	ZINC000082788303	572111551	/nfs/dbraw/zinc/11/15/51/572111551.db2.gz	JBFKBWGOYKLRDJ-UHFFFAOYSA-N	1	2	199.297	3.975	10	0		AHAELO
CCCC[C@@H](C)c1cccc(C)[nH+]1	ZINC000140188480	571727172	/nfs/dbraw/zinc/72/71/72/571727172.db2.gz	ZLNAGNPGFQLJTC-SNVBAGLBSA-N	1	2	177.291	3.684	10	0		AHAELO
CCCCc1ccc(CCCC)[nH+]c1	ZINC000140189062	571787341	/nfs/dbraw/zinc/78/73/41/571787341.db2.gz	AFWDIZWRRROOCQ-UHFFFAOYSA-N	1	2	191.318	3.767	10	0		AHAELO
CCCCc1ccc(C(C)C)[nH+]c1	ZINC000167827795	571964030	/nfs/dbraw/zinc/96/40/30/571964030.db2.gz	XDBMBFQVHHFUTH-UHFFFAOYSA-N	1	2	177.291	3.548	10	0		AHAELO
Cc1cc2cc(Cl)ccc2c(C)[nH+]1	ZINC000196630002	351777037	/nfs/dbraw/zinc/77/70/37/351777037.db2.gz	UXIDNCBGQVOCNH-UHFFFAOYSA-N	1	2	191.661	3.505	10	0		AHAELO
CCc1ccc(C)c2[nH+]c(C)cc(C)c12	ZINC000215760505	344391897	/nfs/dbraw/zinc/39/18/97/344391897.db2.gz	FBAPXTOVNZWXLI-UHFFFAOYSA-N	1	2	199.297	3.722	10	0		AHAELO
Cc1ccc(-c2cc(C)cc(C)[nH+]2)cc1	ZINC000238555353	572815574	/nfs/dbraw/zinc/81/55/74/572815574.db2.gz	RAIMKFOSAUALBM-UHFFFAOYSA-N	1	2	197.281	3.674	10	0		AHAELO