smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(CC(=O)N1CCN(CCO)C[C@@H](O)C1)Cc1ccccc1F	ZINC000217969274	241288497	/nfs/dbraw/zinc/28/84/97/241288497.db2.gz	RWFMMZGXKZGRRR-OAHLLOKOSA-N	0	1	339.411	-0.245	50	70		EBIAMN
Cc1c(C(=O)N2CCn3nc(CO)cc3C2)cnc2cc(=O)[nH]n21	ZINC000217791795	241273983	/nfs/dbraw/zinc/27/39/83/241273983.db2.gz	BEXMDGUTTCXTBF-UHFFFAOYSA-N	0	1	328.332	-0.324	50	70		EBIAMN
C[C@H](O)c1cc2n(n1)CCCN(CCc1c[nH]c(=O)n(C)c1=O)C2	ZINC000217798450	241275112	/nfs/dbraw/zinc/27/51/12/241275112.db2.gz	VISXEUIHCKFITD-NSHDSACASA-N	0	1	333.392	-0.228	50	70		EBIAMN
O[C@@H]1CN(Cc2c[nH]nn2)CCN(Cc2cnn3cccnc23)C1	ZINC000217575588	241261068	/nfs/dbraw/zinc/26/10/68/241261068.db2.gz	IQOAEDBGKHPVLU-AWEZNQCLSA-N	0	1	328.380	-0.474	50	70		EBIAMN
CN(C)C(=O)CO[C@H]1CCOC[C@H]1NC(=O)c1ccc2[nH]nnc2c1	ZINC000218419831	241321708	/nfs/dbraw/zinc/32/17/08/241321708.db2.gz	VBRPHRSUBJGZQD-KGLIPLIRSA-N	0	1	347.375	-0.050	50	70		EBIAMN
C[C@@H](O)c1cc2n(n1)CCCN(CCc1c[nH]c(=O)n(C)c1=O)C2	ZINC000217798394	241274951	/nfs/dbraw/zinc/27/49/51/241274951.db2.gz	VISXEUIHCKFITD-LLVKDONJSA-N	0	1	333.392	-0.228	50	70		EBIAMN
CN(C)CCNc1c(=O)c(=O)c1N1CCN(c2ncccn2)CC1	ZINC000218225926	241308197	/nfs/dbraw/zinc/30/81/97/241308197.db2.gz	TZQWNFDCLYJKSC-UHFFFAOYSA-N	0	1	330.392	-0.627	50	70		EBIAMN
Cc1noc(CN2CCN(c3nc(N)nc4c3CCC4)C[C@@H](O)C2)n1	ZINC000217145589	241237435	/nfs/dbraw/zinc/23/74/35/241237435.db2.gz	CYPKDHHBTHSQDS-NSHDSACASA-N	0	1	345.407	-0.078	50	70		EBIAMN
Cc1nnc(SCCNC(=O)[C@@H]2CCCN2S(C)(=O)=O)[nH]1	ZINC000218509260	241329209	/nfs/dbraw/zinc/32/92/09/241329209.db2.gz	UCVYGOQYRKYUGZ-VIFPVBQESA-N	0	1	333.439	-0.255	50	70		EBIAMN