smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=C1/C(=C\C=C2/CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CCCC(O)(C(F)(F)F)C(F)(F)F)C[C@@H](O)C[C@@H]1O	ZINC000004474583	552461667	/nfs/dbraw/zinc/46/16/67/552461667.db2.gz	XPYGGHVSFMUHLH-UUSULHAXSA-N	0	0	524.586	6.790	30	30	in-man	KKECRN
COc1ccccc1[C@H](c1cccc2ccccc21)[C@@](C)(C#N)C(=O)N1CCC(c2cccc(C(F)(F)F)c2)CC1	ZINC000028865749	561973417	/nfs/dbraw/zinc/97/34/17/561973417.db2.gz	JZPONCMNBSEYQW-CQTOTRCISA-N	0	0	556.628	7.935	30	30		KKECRN