smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(Nc2ccc([NH+](C)C)cc2)c2ccc(C(F)(F)F)cc2[nH+]1	ZINC000005520865	564005038	/nfs/dbraw/zinc/00/50/38/564005038.db2.gz	GQKGODGPBWJMSG-UHFFFAOYSA-N	2	2	345.368	5.372	50	0		EKAALP
CC1=CC(C)=[NH+]c2ccccc2[NH+]=C(C)C=C(C)Nc2ccccc2N1	ZINC000018155533	563849729	/nfs/dbraw/zinc/84/97/29/563849729.db2.gz	SDTVGIGPWYXSSL-UHFFFAOYSA-N	2	2	344.462	6.217	50	0		EKAALP
C[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2)cc1)c1ccc(Cl)cc1Cl	ZINC000022776996	212324046	/nfs/dbraw/zinc/32/40/46/212324046.db2.gz	BNXJFFAETACYOV-CYBMUJFWSA-N	2	2	346.261	5.030	50	0		EKAALP
C[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2)cc1)c1ccc(Cl)cc1Cl	ZINC000022777001	212323894	/nfs/dbraw/zinc/32/38/94/212323894.db2.gz	BNXJFFAETACYOV-ZDUSSCGKSA-N	2	2	346.261	5.030	50	0		EKAALP
C[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2)cc1)c1ccc(Cl)c(Cl)c1	ZINC000022783549	212323435	/nfs/dbraw/zinc/32/34/35/212323435.db2.gz	AOBRHPCJQDRWFN-CYBMUJFWSA-N	2	2	346.261	5.030	50	0		EKAALP
C[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2)cc1)c1ccc(Cl)c(Cl)c1	ZINC000022783555	212323189	/nfs/dbraw/zinc/32/31/89/212323189.db2.gz	AOBRHPCJQDRWFN-ZDUSSCGKSA-N	2	2	346.261	5.030	50	0		EKAALP
C[C@@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)c1ccc(-n2cc[nH+]c2)cc1	ZINC000025356172	563883759	/nfs/dbraw/zinc/88/37/59/563883759.db2.gz	XFDKAMONNPEHGL-CYBMUJFWSA-N	2	2	346.261	5.030	50	0		EKAALP
C[C@H]([NH2+]Cc1ccc(Cl)c(Cl)c1)c1ccc(-n2cc[nH+]c2)cc1	ZINC000025356176	563883628	/nfs/dbraw/zinc/88/36/28/563883628.db2.gz	XFDKAMONNPEHGL-ZDUSSCGKSA-N	2	2	346.261	5.030	50	0		EKAALP
C[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1ccc(-n2cc[nH+]c2)cc1	ZINC000026307407	564039572	/nfs/dbraw/zinc/03/95/72/564039572.db2.gz	GXBBHVCKHVYLCA-CYBMUJFWSA-N	2	2	346.261	5.030	50	0		EKAALP
C[C@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1ccc(-n2cc[nH+]c2)cc1	ZINC000026307411	564081808	/nfs/dbraw/zinc/08/18/08/564081808.db2.gz	GXBBHVCKHVYLCA-ZDUSSCGKSA-N	2	2	346.261	5.030	50	0		EKAALP
C[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)c1ccc(-n2cc[nH+]c2)cc1	ZINC000026307415	202141745	/nfs/dbraw/zinc/14/17/45/202141745.db2.gz	IIDJVTOECIROSS-CYBMUJFWSA-N	2	2	346.261	5.030	50	0		EKAALP
C[C@H]([NH2+]Cc1cccc(Cl)c1Cl)c1ccc(-n2cc[nH+]c2)cc1	ZINC000026307419	202142051	/nfs/dbraw/zinc/14/20/51/202142051.db2.gz	IIDJVTOECIROSS-ZDUSSCGKSA-N	2	2	346.261	5.030	50	0		EKAALP