smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCn1ccc(C[NH2+][C@H](C)c2cccc(C)c2)c1	ZINC000160163975	327598437	/nfs/dbraw/zinc/59/84/37/327598437.db2.gz	NXTGITUOSYNLIH-OAHLLOKOSA-N	1	0	256.393	4.057	10	70		CIIERO
COc1ccccc1[C@@H](C)[NH2+]Cc1cc(F)cc(Cl)c1	ZINC000160811307	330876420	/nfs/dbraw/zinc/87/64/20/330876420.db2.gz	RVSGZLOQCOHODZ-LLVKDONJSA-N	1	0	293.769	4.339	10	70		CIIERO
c1oc2ccccc2c1C[NH2+][C@@H]1CCOc2ccccc21	ZINC000161080934	526627909	/nfs/dbraw/zinc/62/79/09/526627909.db2.gz	PCBWOZLTNFPXAG-MRXNPFEDSA-N	1	0	279.339	4.046	10	70		CIIERO
Fc1cc(F)cc(C[NH2+]C2CCC(C(F)(F)F)CC2)c1	ZINC000159885708	262390828	/nfs/dbraw/zinc/39/08/28/262390828.db2.gz	IDOUAVVFULJDFK-UHFFFAOYSA-N	1	0	293.279	4.176	10	70		CIIERO
c1oc2ccccc2c1C[NH2+][C@H]1CCOc2ccccc21	ZINC000161081062	526629246	/nfs/dbraw/zinc/62/92/46/526629246.db2.gz	PCBWOZLTNFPXAG-INIZCTEOSA-N	1	0	279.339	4.046	10	70		CIIERO
c1cc2cccc(C[NH2+]CCC3CCCCC3)c2[nH]1	ZINC000218089810	333126785	/nfs/dbraw/zinc/12/67/85/333126785.db2.gz	WAZXUZQWSYWMSQ-UHFFFAOYSA-N	1	0	256.393	4.228	10	70		CIIERO
CCC1CCC([NH2+]Cc2cccc3cc[nH]c32)CC1	ZINC000218118826	262995591	/nfs/dbraw/zinc/99/55/91/262995591.db2.gz	KTZLEOYMACRBRX-UHFFFAOYSA-N	1	0	256.393	4.226	10	70		CIIERO