smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
c1c2ccccc2sc1C1=CN2CCC1CC2	ZINC000000017171	187244162	/nfs/dbraw/zinc/24/41/62/187244162.db2.gz	SFSDXYWNODMHCY-UHFFFAOYSA-N	0	1	241.359	3.968	1	0		BHAFMN
Cc1c2ccccc2oc1C1=CN2CCC1CC2	ZINC000013757477	177577433	/nfs/dbraw/zinc/57/74/33/177577433.db2.gz	AESSYHBGSGYEPG-UHFFFAOYSA-N	0	1	239.318	3.808	1	0		BHAFMN
Cc1cccc2cc(C3=CN4CCC3CC4)oc21	ZINC000013757480	179227485	/nfs/dbraw/zinc/22/74/85/179227485.db2.gz	GQAHLUHWIIZPFR-UHFFFAOYSA-N	0	1	239.318	3.808	1	0		BHAFMN
c1ccc(-c2cc3[nH]c4ccccc4c3nn2)cc1	ZINC000014970089	183379441	/nfs/dbraw/zinc/37/94/41/183379441.db2.gz	URNLOOIGUNQTFL-UHFFFAOYSA-N	0	1	245.285	3.778	1	0		BHAFMN
c1ccc(-c2cc3nc4ccccc4c-3n[nH]2)cc1	ZINC000014970089	183379438	/nfs/dbraw/zinc/37/94/38/183379438.db2.gz	URNLOOIGUNQTFL-UHFFFAOYSA-N	0	1	245.285	3.778	1	0		BHAFMN
CC1=CC(=N)C(c2ccccc2)(c2ccccc2)O1	ZINC000026734492	168091397	/nfs/dbraw/zinc/09/13/97/168091397.db2.gz	ZJXAYZBBAIAJFD-UHFFFAOYSA-N	0	1	249.313	3.884	1	0		BHAFMN
CC1=N[C@@H](c2ccccc2)Cc2ccccc2N1	ZINC000027100364	168138011	/nfs/dbraw/zinc/13/80/11/168138011.db2.gz	PYRSCMLYSARZTK-MRXNPFEDSA-N	0	1	236.318	3.814	1	0		BHAFMN
CC1=N[C@H](c2ccccc2)Cc2ccccc2N1	ZINC000027100368	168137554	/nfs/dbraw/zinc/13/75/54/168137554.db2.gz	PYRSCMLYSARZTK-INIZCTEOSA-N	0	1	236.318	3.814	1	0		BHAFMN
CCc1ccc(O)c(C(=O)c2ccc(C)s2)c1	ZINC000028762063	171823409	/nfs/dbraw/zinc/82/34/09/171823409.db2.gz	CWBJHOKXRNQVLV-UHFFFAOYSA-N	0	1	246.331	3.556	1	0		BHAFMN
Oc1ccc(-c2nc3ccccc3o2)cc1Cl	ZINC000028964562	183266565	/nfs/dbraw/zinc/26/65/65/183266565.db2.gz	MMRWATBCSASKAI-UHFFFAOYSA-N	0	1	245.665	3.854	1	0		BHAFMN
c1ccc(-c2nc3cc4cccnc4cc3[nH]2)cc1	ZINC000082158034	183383483	/nfs/dbraw/zinc/38/34/83/183383483.db2.gz	FEIVWJZGTQSUEU-UHFFFAOYSA-N	0	1	245.285	3.778	1	0		BHAFMN
c1ccc(-c2nc3cc4ccc[nH]c4cc3n2)cc1	ZINC000082158034	183383482	/nfs/dbraw/zinc/38/34/82/183383482.db2.gz	FEIVWJZGTQSUEU-UHFFFAOYSA-N	0	1	245.285	3.778	1	0		BHAFMN
CCC(=O)CC/C=C/C=C/C1=N[C@H](C)C=CC=C1	ZINC000143670001	168199103	/nfs/dbraw/zinc/19/91/03/168199103.db2.gz	YHYHJUHRELVMJW-WCPNHCKHSA-N	0	1	243.350	3.814	1	0		BHAFMN
CCC(=O)CC/C=C/C=C/C1=N[C@@H](C)C=CC=C1	ZINC000143670175	168198968	/nfs/dbraw/zinc/19/89/68/168198968.db2.gz	YHYHJUHRELVMJW-JJJKBCINSA-N	0	1	243.350	3.814	1	0		BHAFMN