smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH2+][C@@H]1CCC[C@@H](c2c[nH]c3ccc(NC(=[NH2+])c4cccs4)cc32)C1	ZINC000195522243	206332805	/nfs/dbraw/zinc/33/28/05/206332805.db2.gz	FMQPLHSUIOCWGC-ZIAGYGMSSA-N	2	2	352.507	4.912	1	0		FJAFLP
CC[NH+](CC)CCC[N@@H+]1CC=C2c3ccccc3C(c3ccccc3)=C2C1	ZINC000039223512	205044529	/nfs/dbraw/zinc/04/45/29/205044529.db2.gz	JVUOSBPMBYBDSJ-UHFFFAOYSA-N	2	2	358.529	4.933	1	0		FJAFLP
CC[NH+](CC)CCC[N@H+]1CC=C2c3ccccc3C(c3ccccc3)=C2C1	ZINC000039223512	205044534	/nfs/dbraw/zinc/04/45/34/205044534.db2.gz	JVUOSBPMBYBDSJ-UHFFFAOYSA-N	2	2	358.529	4.933	1	0		FJAFLP
C[NH+](C)[C@H]1CCCC[C@@H]1Oc1ccc(-c2cccc(N)[nH+]2)c2ccccc12	ZINC000029343543	204898732	/nfs/dbraw/zinc/89/87/32/204898732.db2.gz	HAUBUNNZVAGIGM-UNMCSNQZSA-N	2	2	361.489	4.736	1	0		FJAFLP
Cc1cc(C[NH+]2CCCC2)c(C)n1Nc1cc[nH+]c2cc(Cl)ccc12	ZINC000040430683	205070024	/nfs/dbraw/zinc/07/00/24/205070024.db2.gz	MURFQFOMMRDIIU-UHFFFAOYSA-N	2	2	354.885	4.778	1	0		FJAFLP
CCCCn1c2ccccc2c2cc(C[NH2+]CCC[NH+](CC)CC)ncc21	ZINC000053313754	205192652	/nfs/dbraw/zinc/19/26/52/205192652.db2.gz	RRCRAUDLHDNLNB-UHFFFAOYSA-N	2	2	366.553	4.811	1	0		FJAFLP
Clc1ccc(C[NH+]2CCC([NH2+]C3C4CC5CC(C4)CC3C5)CC2)cc1	ZINC000040894589	205084221	/nfs/dbraw/zinc/08/42/21/205084221.db2.gz	RZZAHLLQLSKGSP-UHFFFAOYSA-N	2	2	358.957	4.719	1	0		FJAFLP
CCCc1ccc2c(c1)CC=C(c1ccccc1)C(N1CC[NH+](C)CC1)=[NH+]2	ZINC000102116007	222289156	/nfs/dbraw/zinc/28/91/56/222289156.db2.gz	NNUXVQJBURIDOK-UHFFFAOYSA-N	2	2	359.517	4.556	1	0		FJAFLP
Fc1ccc(C[NH2+][C@H]2CC[C@H](C(c3ccccc3)c3ccccc3)[NH2+]C2)cc1	ZINC000038322612	205039682	/nfs/dbraw/zinc/03/96/82/205039682.db2.gz	KQGGYEZSINLKFH-BJKOFHAPSA-N	2	2	374.503	4.868	1	0		FJAFLP
Cc1cc(-c2cccc(C[NH2+]CCc3ccc(Cl)cc3)c2)c[nH+]c1N	ZINC000045320654	205120565	/nfs/dbraw/zinc/12/05/65/205120565.db2.gz	AIGSJZRJEDXSRO-UHFFFAOYSA-N	2	2	351.881	4.625	1	0		FJAFLP
Cc1ccc([C@H]([NH3+])[C@@H]2CC[N@@H+]2C(c2ccccc2)c2ccccc2)cc1F	ZINC000022941570	211370660	/nfs/dbraw/zinc/37/06/60/211370660.db2.gz	WRBMJDRZZULRBX-GOTSBHOMSA-N	2	2	360.476	4.998	1	0		FJAFLP
Cc1ccc([C@H]([NH3+])[C@@H]2CC[N@H+]2C(c2ccccc2)c2ccccc2)cc1F	ZINC000022941570	211370662	/nfs/dbraw/zinc/37/06/62/211370662.db2.gz	WRBMJDRZZULRBX-GOTSBHOMSA-N	2	2	360.476	4.998	1	0		FJAFLP
C[NH2+][C@H]1CC[C@@H](c2c[nH]c3ccc(NC(=[NH2+])c4cccs4)cc32)CC1	ZINC000101509246	222278365	/nfs/dbraw/zinc/27/83/65/222278365.db2.gz	DYNODBXGYMORGO-HDJSIYSDSA-N	2	2	352.507	4.912	1	0		FJAFLP
c1ccc2c(c1)[nH+]cc1c2N(CC[NH+]2CCCCC2)c2cccnc2S1	ZINC000098082839	132231829	/nfs/dbraw/zinc/23/18/29/132231829.db2.gz	SOEWDSODMIPXKV-UHFFFAOYSA-N	2	2	362.502	4.718	1	0		FJAFLP
CC1(C)C[NH2+]Cc2c3[nH]c(Nc4c(Cl)cccc4Cl)[nH+]c3ccc21	ZINC000013475198	220069458	/nfs/dbraw/zinc/06/94/58/220069458.db2.gz	RWLRSQSRJNWRJK-UHFFFAOYSA-N	2	2	361.276	4.994	1	0		FJAFLP
CC1(C)C[NH2+]Cc2c3[nH+]c(Nc4c(Cl)cccc4Cl)[nH]c3ccc21	ZINC000013475198	220069459	/nfs/dbraw/zinc/06/94/59/220069459.db2.gz	RWLRSQSRJNWRJK-UHFFFAOYSA-N	2	2	361.276	4.994	1	0		FJAFLP
Clc1ccc([C@H](c2ccc(C[NH+]3CCCC3)cc2)n2cc[nH+]c2)cc1	ZINC000035246369	208120997	/nfs/dbraw/zinc/12/09/97/208120997.db2.gz	DBNOSIUJVKLZRW-NRFANRHFSA-N	2	2	351.881	4.770	1	0		FJAFLP
C1C2CC3CC1CC(C2)C3[NH+]1CCC[N@@H+](C2C3CC4CC(C3)CC2C4)CC1	ZINC000022782485	220399418	/nfs/dbraw/zinc/39/94/18/220399418.db2.gz	USLMSRRGTCBRDN-UHFFFAOYSA-N	2	2	368.609	4.644	1	0		FJAFLP
C1C2CC3CC1CC(C2)C3[NH+]1CCC[N@H+](C2C3CC4CC(C3)CC2C4)CC1	ZINC000022782485	220399421	/nfs/dbraw/zinc/39/94/21/220399421.db2.gz	USLMSRRGTCBRDN-UHFFFAOYSA-N	2	2	368.609	4.644	1	0		FJAFLP
CC(C)c1ccc2c(c1)CC=C(c1ccccc1)C(N1CC[NH+](C)CC1)=[NH+]2	ZINC000101167560	222265092	/nfs/dbraw/zinc/26/50/92/222265092.db2.gz	GVJICTNRRRAALR-UHFFFAOYSA-N	2	2	359.517	4.727	1	0		FJAFLP
CCc1ccc2c(c1)CC=C(c1ccccc1)C(N1CC[NH+](C(C)C)CC1)=[NH+]2	ZINC000102091603	209232651	/nfs/dbraw/zinc/23/26/51/209232651.db2.gz	OXGFUMZROOXADD-UHFFFAOYSA-N	2	2	373.544	4.945	1	0		FJAFLP
CCCc1ccc2c(c1)CC=C(c1ccccc1)C(N1CC[NH+](CC)CC1)=[NH+]2	ZINC000100764016	222251715	/nfs/dbraw/zinc/25/17/15/222251715.db2.gz	AOCFSQZCKHYCDU-UHFFFAOYSA-N	2	2	373.544	4.946	1	0		FJAFLP
Fc1ccc(C[NH2+][C@H]2CC[C@@H](C(c3ccccc3)c3ccccc3)[NH2+]C2)cc1	ZINC000038289027	208202113	/nfs/dbraw/zinc/20/21/13/208202113.db2.gz	KQGGYEZSINLKFH-ZEQRLZLVSA-N	2	2	374.503	4.868	1	0		FJAFLP
CCc1ccc2c(c1)CC=C(c1ccccc1)C(N1CC[NH+](CC)CC1)=[NH+]2	ZINC000101761057	222282989	/nfs/dbraw/zinc/28/29/89/222282989.db2.gz	OODKZSFMFWCVQT-UHFFFAOYSA-N	2	2	359.517	4.556	1	0		FJAFLP
Clc1ccc(C[NH+]2CCC([NH2+]C34CC5CC(CC(C5)C3)C4)CC2)cc1	ZINC000040394948	208251578	/nfs/dbraw/zinc/25/15/78/208251578.db2.gz	RFQWOEYYEIRCHO-UHFFFAOYSA-N	2	2	358.957	4.863	1	0		FJAFLP