smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)/C=C1\C=Cc2ccccc21	72103629	573685696	/nfs/dbraw/zinc/68/56/96/573685696.db2.gz	APROKXRMPOTDTP-PKNBQFBNSA-N	0	1	171.243	2.616	1	0		AFAFMN
C1=CC2=Nc3ccccc3[C@H]2C=C1	1866749	560185142	/nfs/dbraw/zinc/18/51/42/560185142.db2.gz	CYBHWCLUGRHMCK-SECBINFHSA-N	0	1	167.211	2.982	1	0	in-vitro	AFAFMN
N=Cc1ccc(-c2cccnc2)s1	28125038	169144605	/nfs/dbraw/zinc/14/46/05/169144605.db2.gz	VVFTYYAQYNDSKF-UHFFFAOYSA-N	0	1	188.255	2.808	1	0		AFAFMN
CC1(C)OC(c2ccccc2)=CC1=N	26729150	171046001	/nfs/dbraw/zinc/04/60/01/171046001.db2.gz	UTAFRYHTQHIFPM-UHFFFAOYSA-N	0	1	187.242	2.856	1	0		AFAFMN
Cc1cc(C)c2c(O)csc2c1	84403422	343636033	/nfs/dbraw/zinc/63/60/33/343636033.db2.gz	RPXZCHRNIQULPE-UHFFFAOYSA-N	0	1	178.256	2.592	1	0		AFAFMN