smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1csc(NC2=CCCC2)c1	ZINC001173997209	761321471	/nfs/dbraw/zinc/32/14/71/761321471.db2.gz	IWENQZVEEXGZLU-UHFFFAOYSA-N	0	1	179.288	3.536	20	0		AHADMN
Clc1ccc(NC2=CCCC2)s1	ZINC001173998665	761319903	/nfs/dbraw/zinc/31/99/03/761319903.db2.gz	KEYQNALAYGTSCO-UHFFFAOYSA-N	0	1	199.706	3.881	20	0		AHADMN
c1cc2cccc(N=C3CCCC3)c2o1	ZINC001173998977	761326439	/nfs/dbraw/zinc/32/64/39/761326439.db2.gz	YQTGPKOQBFPQFZ-UHFFFAOYSA-N	0	1	199.253	3.913	20	0		AHADMN
c1csc(NC2=CCCCC2)c1	ZINC001175752369	761419402	/nfs/dbraw/zinc/41/94/02/761419402.db2.gz	MYKJBBAYBXNTDC-UHFFFAOYSA-N	0	1	179.288	3.618	20	0		AHADMN
Cc1csc(NC2=CCCCC2)c1	ZINC001175753630	761419160	/nfs/dbraw/zinc/41/91/60/761419160.db2.gz	XZDSBBHMCBRJRF-UHFFFAOYSA-N	0	1	193.315	3.926	20	0		AHADMN
c1cc(N=C2CCCCCCC2)co1	ZINC001210448683	762339713	/nfs/dbraw/zinc/33/97/13/762339713.db2.gz	OSUALKZBNADTRM-UHFFFAOYSA-N	0	1	191.274	3.930	20	0		AHADMN
CCC(C)=Nc1cc2ccccc2cn1	ZINC001210792516	762345599	/nfs/dbraw/zinc/34/55/99/762345599.db2.gz	OFAOVLNESVEQGV-XCVCLJGOSA-N	0	1	198.269	3.570	20	0		AHADMN
CCC(C)=Nc1cccc(C(C)C)n1	ZINC001210792637	762349130	/nfs/dbraw/zinc/34/91/30/762349130.db2.gz	OMAMWJJSZDQBCO-BJMVGYQFSA-N	0	1	190.290	3.541	20	0		AHADMN
CC=C(C)Nc1nccc2ccccc21	ZINC001210793345	762348918	/nfs/dbraw/zinc/34/89/18/762348918.db2.gz	YAKIQSKOEGVUPQ-XCVCLJGOSA-N	0	1	198.269	3.570	20	0		AHADMN
CCC(C)=Nc1ccc2ccccc2n1	ZINC001210793346	762349819	/nfs/dbraw/zinc/34/98/19/762349819.db2.gz	YDROGWCKLIUJAD-XCVCLJGOSA-N	0	1	198.269	3.570	20	0		AHADMN
CC=C(C)Nc1ccc(Cl)s1	ZINC001210793354	762351536	/nfs/dbraw/zinc/35/15/36/762351536.db2.gz	NUVBKSNXPJHWPP-ZZXKWVIFSA-N	0	1	187.695	3.737	20	0		AHADMN
CC=C(C)Nc1cc(Cl)cs1	ZINC001210793381	762350679	/nfs/dbraw/zinc/35/06/79/762350679.db2.gz	NZBRMXWCEPXVQU-ZZXKWVIFSA-N	0	1	187.695	3.737	20	0		AHADMN
CCC(C)=Nc1ncccc1C(C)C	ZINC001210794821	762356273	/nfs/dbraw/zinc/35/62/73/762356273.db2.gz	OQZXGOSUYUEONU-BJMVGYQFSA-N	0	1	190.290	3.541	20	0		AHADMN
CC=C(C)Nc1c(F)cccc1Cl	ZINC001210795149	762353256	/nfs/dbraw/zinc/35/32/56/762353256.db2.gz	TUJQGLNNCGRUKD-XVNBXDOJSA-N	0	1	199.656	3.815	20	0		AHADMN
c1cc2c(ccnc2C2=CCCCC2)[nH]1	ZINC001241712275	764984230	/nfs/dbraw/zinc/98/42/30/764984230.db2.gz	CFLAEINXLVFLCO-UHFFFAOYSA-N	0	1	198.269	3.520	20	0		AHADMN
c1cc2cnc(C3=CCCCC3)cc2[nH]1	ZINC001241713892	764982077	/nfs/dbraw/zinc/98/20/77/764982077.db2.gz	SSYHNFUOSVXHCF-UHFFFAOYSA-N	0	1	198.269	3.520	20	0		AHADMN
c1nc2cccc(C3=CCCCC3)c2[nH]1	ZINC001241716912	764991124	/nfs/dbraw/zinc/99/11/24/764991124.db2.gz	LWLZJPHPSZDRMH-UHFFFAOYSA-N	0	1	198.269	3.520	20	0		AHADMN
c1nc2ccc(C3=CCCCC3)cc2[nH]1	ZINC001241716960	764986727	/nfs/dbraw/zinc/98/67/27/764986727.db2.gz	NYLMFQJGTRIAOD-UHFFFAOYSA-N	0	1	198.269	3.520	20	0		AHADMN
CC(C)(C)Cc1cccc(S)c1	ZINC001249926706	765375604	/nfs/dbraw/zinc/37/56/04/765375604.db2.gz	BQCVTGLNAAZEFQ-UHFFFAOYSA-N	0	1	180.316	3.564	20	0		AHADMN