smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Sc1ccccc1-c1ccccc1	ZINC000004269985	171011810	/nfs/dbraw/zinc/01/18/10/171011810.db2.gz	UECUPGFJVNJNQA-UHFFFAOYSA-N	0	2	186.279	3.642	40	0		AHABLN
Sc1cccc(-c2ccccc2)c1	ZINC000034500507	171056043	/nfs/dbraw/zinc/05/60/43/171056043.db2.gz	KAPVNBHFGIODTQ-UHFFFAOYSA-N	0	2	186.279	3.642	40	0		AHABLN
CCCCCOc1ccc(S)cc1	ZINC000036533045	343146694	/nfs/dbraw/zinc/14/66/94/343146694.db2.gz	WCNYVNGKHVOZMS-UHFFFAOYSA-N	0	2	196.315	3.544	40	0		AHABLN
CCCCCOc1ccccc1S	ZINC000060236357	343352116	/nfs/dbraw/zinc/35/21/16/343352116.db2.gz	PZEPHEBEJKGATR-UHFFFAOYSA-N	0	2	196.315	3.544	40	0		AHABLN
CCCCCOc1cccc(S)c1	ZINC000080351233	343591470	/nfs/dbraw/zinc/59/14/70/343591470.db2.gz	MSBWHAYRQAXZDJ-UHFFFAOYSA-N	0	2	196.315	3.544	40	0		AHABLN
CCCCSc1ccc(S)cc1	ZINC000095731467	343686571	/nfs/dbraw/zinc/68/65/71/343686571.db2.gz	IAIFQYCINHEYAM-UHFFFAOYSA-N	0	2	198.356	3.868	40	0		AHABLN
CCCCSc1cccc(S)c1	ZINC000095731471	343686545	/nfs/dbraw/zinc/68/65/45/343686545.db2.gz	MZAOVDPSMCBPHU-UHFFFAOYSA-N	0	2	198.356	3.868	40	0		AHABLN
CCCCSc1ccccc1S	ZINC000095731474	343686560	/nfs/dbraw/zinc/68/65/60/343686560.db2.gz	XWXAKCPKOITTOX-UHFFFAOYSA-N	0	2	198.356	3.868	40	0		AHABLN
CC(C)CSc1ccc(S)cc1	ZINC000095731653	166479957	/nfs/dbraw/zinc/47/99/57/166479957.db2.gz	GYEPOCYSTQARPG-UHFFFAOYSA-N	0	2	198.356	3.723	40	0		AHABLN
CC(C)CSc1cccc(S)c1	ZINC000095731657	351672900	/nfs/dbraw/zinc/67/29/00/351672900.db2.gz	FRLUGXMOVVJHMI-UHFFFAOYSA-N	0	2	198.356	3.723	40	0		AHABLN
CC(C)CSc1ccccc1S	ZINC000095731659	351672700	/nfs/dbraw/zinc/67/27/00/351672700.db2.gz	AMMVNVFGVJZUJV-UHFFFAOYSA-N	0	2	198.356	3.723	40	0		AHABLN