smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@H](c2nnc3n2CC[NH2+]CC3)C1	ZINC000019709211	207151294	/nfs/dbraw/zinc/15/12/94/207151294.db2.gz	RKRXBZGXUPHRNO-IBGZPJMESA-N	2	0	380.540	2.404	40	10		GECBRP
COc1ccc2[nH+]c3cc(Cl)ccc3c(NCC[NH2+]C[C@H](O)CO)c2c1	ZINC000006484895	570481475	/nfs/dbraw/zinc/48/14/75/570481475.db2.gz	AEZQYPDALGTGLM-ZDUSSCGKSA-N	2	0	375.856	2.405	40	10		GECBRP
c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@@H](c2nnc3n2CC[NH2+]CC3)C1	ZINC000019709210	210283082	/nfs/dbraw/zinc/28/30/82/210283082.db2.gz	RKRXBZGXUPHRNO-LJQANCHMSA-N	2	0	380.540	2.404	40	10		GECBRP
C[NH+](C)CCNc1cccc2c1C(=O)c1cccc(NCC[NH+](C)C)c1C2=O	ZINC000005140452	570897829	/nfs/dbraw/zinc/89/78/29/570897829.db2.gz	DPKDBVSAHDKACA-UHFFFAOYSA-N	2	0	380.492	2.409	40	10		GECBRP
Cc1cc(OCCOc2ccc(N)cc2)ccc1N1C(=[NH2+])NC(=[NH2+])NC1(C)C	ZINC000017040572	210201503	/nfs/dbraw/zinc/20/15/03/210201503.db2.gz	GCRYKUSDSIVNLW-UHFFFAOYSA-N	2	0	382.468	2.221	40	10		GECBRP
COc1ccc(N2CCC[N@H+](CC3CC[NH+](CC(=O)N(C)C)CC3)CC2)cc1	ZINC000072338583	222229943	/nfs/dbraw/zinc/22/99/43/222229943.db2.gz	FETHWLKCACORFR-UHFFFAOYSA-N	2	0	388.556	2.008	40	10		GECBRP
COc1ccc2[nH+]c3cc(Cl)ccc3c(NCC[NH2+]C[C@@H](O)CO)c2c1	ZINC000004428891	570374947	/nfs/dbraw/zinc/37/49/47/570374947.db2.gz	AEZQYPDALGTGLM-CYBMUJFWSA-N	2	0	375.856	2.405	40	10		GECBRP