smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+](C)CCC[NH+]=C1CC(C)(C)c2c(Cl)cccc2N1	ZINC000096908687	185127906	/nfs/dbraw/zinc/12/79/06/185127906.db2.gz	GULAHBLBBUFFFJ-UHFFFAOYSA-N	2	0	293.842	3.783	1	30		CHEFRP
C(#Cc1cccc(C[NH+]2CCCC2)c1)CC[NH+]1CCCCC1	ZINC000038410367	174141188	/nfs/dbraw/zinc/14/11/88/174141188.db2.gz	CQEZMXAJOCXNTK-UHFFFAOYSA-N	2	0	296.458	3.510	1	30		CHEFRP
CCCCCCCCCCCC[NH2+]C[C@@H]([NH3+])CCCC[NH3+]	ZINC000043335110	175011517	/nfs/dbraw/zinc/01/15/17/175011517.db2.gz	IPMUJTQGCGQSBU-SFHVURJKSA-N	3	0	299.547	3.953	1	30		CHEFRP
C(#Cc1ccc(C[NH+]2CCCC2)cc1)CC[NH+]1CCCCC1	ZINC000045287571	175353918	/nfs/dbraw/zinc/35/39/18/175353918.db2.gz	AFLLBHCLMHXGNC-UHFFFAOYSA-N	2	0	296.458	3.510	1	30		CHEFRP
C=CCCCCCC[n+]1cccc([C@@H]2CCC[N@H+]2C)c1	ZINC000038930102	174159790	/nfs/dbraw/zinc/15/97/90/174159790.db2.gz	TUNDIRUBCYUYEE-SFHVURJKSA-N	2	0	273.444	3.877	1	30		CHEFRP
C[NH+](C)CCC[NH+]=C1CC(C)(C)c2ccc(Cl)cc2N1	ZINC000096908688	185128117	/nfs/dbraw/zinc/12/81/17/185128117.db2.gz	PJQBARGEWWZSHA-UHFFFAOYSA-N	2	0	293.842	3.783	1	30		CHEFRP
CC[NH+](CC)CCC#Cc1ccc(C[NH+]2CCCCC2)cc1	ZINC000038387516	174141079	/nfs/dbraw/zinc/14/10/79/174141079.db2.gz	PTFIENMCHFMYSY-UHFFFAOYSA-N	2	0	298.474	3.756	1	30		CHEFRP
CCCCCCCCCCCC[NH2+]C[C@H]([NH3+])CCCC[NH3+]	ZINC000043335108	175011461	/nfs/dbraw/zinc/01/14/61/175011461.db2.gz	IPMUJTQGCGQSBU-GOSISDBHSA-N	3	0	299.547	3.953	1	30		CHEFRP
c1cc(C[S+]2CCCC2)sc1C[S+]1CCCC1	ZINC000005855892	170147396	/nfs/dbraw/zinc/14/73/96/170147396.db2.gz	BOBDEWOJIAYMED-UHFFFAOYSA-N	2	0	286.531	3.572	1	30		CHEFRP
C[NH+](C)CCC[NH+]=C1CC(C)(C)c2cc(Cl)ccc2N1	ZINC000096908698	185128040	/nfs/dbraw/zinc/12/80/40/185128040.db2.gz	CYBQLRQRUWFLLB-UHFFFAOYSA-N	2	0	293.842	3.783	1	30		CHEFRP