smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc([C@H](CC(C)C)NC(=O)CC2CCN(C)CC2)cc1	ZINC000216902184	536912454	/nfs/dbraw/zinc/91/24/54/536912454.db2.gz	FVTYOGSEGZGCSW-IBGZPJMESA-N	0	3	332.488	3.631	40	70		EHIBHN
C[C@H](CNC(=O)CC1CCN(C)CC1)Cc1cccc2ccccc21	ZINC000216903970	241219811	/nfs/dbraw/zinc/21/98/11/241219811.db2.gz	XRVQKCOIBMLDOR-KRWDZBQOSA-N	0	3	338.495	3.867	40	70		EHIBHN
COc1ccc([C@@H](CC(C)C)NC(=O)CC2CCN(C)CC2)cc1	ZINC000216902150	241220055	/nfs/dbraw/zinc/22/00/55/241220055.db2.gz	FVTYOGSEGZGCSW-LJQANCHMSA-N	0	3	332.488	3.631	40	70		EHIBHN
CN1CCC(CC(=O)NCCCSc2ccc(Cl)cc2)CC1	ZINC000216903025	241219400	/nfs/dbraw/zinc/21/94/00/241219400.db2.gz	MSJXGYCJTAOTSL-UHFFFAOYSA-N	0	3	340.920	3.670	40	70		EHIBHN
CN1CCC(CC(=O)N(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000216892459	536336035	/nfs/dbraw/zinc/33/60/35/536336035.db2.gz	ZUDPORLJNUQZLD-UHFFFAOYSA-N	0	3	336.479	3.947	40	70		EHIBHN
C[C@@H](CNC(=O)CC1CCN(C)CC1)Cc1cccc2ccccc21	ZINC000216903939	241221269	/nfs/dbraw/zinc/22/12/69/241221269.db2.gz	XRVQKCOIBMLDOR-QGZVFWFLSA-N	0	3	338.495	3.867	40	70		EHIBHN
CN1CCC(Oc2ccc(NC(=S)Nc3ccccc3)cc2)CC1	ZINC000216927230	241224541	/nfs/dbraw/zinc/22/45/41/241224541.db2.gz	SCUGUSJSOGFYPZ-UHFFFAOYSA-N	0	3	341.480	3.969	40	70		EHIBHN
CN1CCC(CC(=O)Nc2ccccc2C(=O)c2ccccc2)CC1	ZINC000216900427	536336840	/nfs/dbraw/zinc/33/68/40/536336840.db2.gz	GGOIJLUAVCRJMD-UHFFFAOYSA-N	0	3	336.435	3.588	40	70		EHIBHN
Cc1ccc([C@@H](NC(=O)CC2CCN(C)CC2)c2ccccc2)cc1	ZINC000216902236	241219332	/nfs/dbraw/zinc/21/93/32/241219332.db2.gz	UJKXGIFSANAUJR-QFIPXVFZSA-N	0	3	336.479	3.933	40	70		EHIBHN
Cc1cccc([C@H](NC(=O)CC2CCN(C)CC2)c2ccccc2)c1	ZINC000216905040	241220090	/nfs/dbraw/zinc/22/00/90/241220090.db2.gz	ZVAGSKZFHFNHNI-JOCHJYFZSA-N	0	3	336.479	3.933	40	70		EHIBHN
Cc1ccc(CC(=O)Nc2ccc(OC3CCN(C)CC3)cc2)cc1	ZINC000217020605	241230463	/nfs/dbraw/zinc/23/04/63/241230463.db2.gz	PLJSZRTXDQGYCG-UHFFFAOYSA-N	0	3	338.451	3.649	40	70		EHIBHN
Cc1cccc([C@@H](NC(=O)CC2CCN(C)CC2)c2ccccc2)c1	ZINC000216905005	241218973	/nfs/dbraw/zinc/21/89/73/241218973.db2.gz	ZVAGSKZFHFNHNI-QFIPXVFZSA-N	0	3	336.479	3.933	40	70		EHIBHN
CN1CCC(CC(=O)Nc2ccc(Br)c(Cl)c2)CC1	ZINC000216895535	536336286	/nfs/dbraw/zinc/33/62/86/536336286.db2.gz	QNTFPNCPCMNWSP-UHFFFAOYSA-N	0	3	345.668	3.773	40	70		EHIBHN
Cc1ccc([C@H](NC(=O)CC2CCN(C)CC2)c2ccccc2)cc1	ZINC000216902270	241219019	/nfs/dbraw/zinc/21/90/19/241219019.db2.gz	UJKXGIFSANAUJR-JOCHJYFZSA-N	0	3	336.479	3.933	40	70		EHIBHN