smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCc1[nH+]c2cc(C(F)(F)F)ccc2n1CCC[NH+](CC)CC	ZINC000040403521	213298608	/nfs/dbraw/zinc/29/86/08/213298608.db2.gz	RZTKOIVNDIWUAO-UHFFFAOYSA-N	2	2	341.421	4.740	10	0		EJAELP
C[N@@H+]1CCC[C@H]1CCNc1cc(-c2ccccc2F)[nH+]c2ccccc12	ZINC000028639824	201388598	/nfs/dbraw/zinc/38/85/98/201388598.db2.gz	CZCSWFVUTOONAK-INIZCTEOSA-N	2	2	349.453	4.937	10	0		EJAELP
C[N@H+]1CCC[C@H]1CCNc1cc(-c2ccccc2F)[nH+]c2ccccc12	ZINC000028639824	201388602	/nfs/dbraw/zinc/38/86/02/201388602.db2.gz	CZCSWFVUTOONAK-INIZCTEOSA-N	2	2	349.453	4.937	10	0		EJAELP
Clc1ccc(C[N@H+](CC2CCCCC2)[C@@H]2CC[NH2+]C2)cc1Cl	ZINC000090487981	201372047	/nfs/dbraw/zinc/37/20/47/201372047.db2.gz	JRYMCXIUJOQABJ-MRXNPFEDSA-N	2	2	341.326	4.738	10	0		EJAELP
Clc1ccc(C[N@@H+](CC2CCCCC2)[C@@H]2CC[NH2+]C2)cc1Cl	ZINC000090487981	201372048	/nfs/dbraw/zinc/37/20/48/201372048.db2.gz	JRYMCXIUJOQABJ-MRXNPFEDSA-N	2	2	341.326	4.738	10	0		EJAELP
C[NH+](C)CCNc1cc(-c2ccsc2)[nH+]c2ccc(Cl)cc12	ZINC000253495152	244003232	/nfs/dbraw/zinc/00/32/32/244003232.db2.gz	AHKRGYSQRBXQJG-UHFFFAOYSA-N	2	2	331.872	4.590	10	0		EJAELP
C[C@@H]1CCC[C@H](C)[N@H+]1[C@H](C[NH3+])c1ccc(OCc2ccccc2)cc1	ZINC000039789212	213242363	/nfs/dbraw/zinc/24/23/63/213242363.db2.gz	PQPSQANTEPXUKX-KGVIQGDOSA-N	2	2	338.495	4.528	10	0		EJAELP
C[C@@H]1CCC[C@H](C)[N@@H+]1[C@H](C[NH3+])c1ccc(OCc2ccccc2)cc1	ZINC000039789212	213242367	/nfs/dbraw/zinc/24/23/67/213242367.db2.gz	PQPSQANTEPXUKX-KGVIQGDOSA-N	2	2	338.495	4.528	10	0		EJAELP
CCCC[N@H+]([C@H](C)CC)[C@@H](c1ccc(Br)s1)[C@@H](C)[NH3+]	ZINC000103931970	219330353	/nfs/dbraw/zinc/33/03/53/219330353.db2.gz	FSZJLEVFHUMLEJ-LALPHHSUSA-N	2	2	347.366	4.800	10	0		EJAELP
CCCC[N@@H+]([C@H](C)CC)[C@@H](c1ccc(Br)s1)[C@@H](C)[NH3+]	ZINC000103931970	219330354	/nfs/dbraw/zinc/33/03/54/219330354.db2.gz	FSZJLEVFHUMLEJ-LALPHHSUSA-N	2	2	347.366	4.800	10	0		EJAELP