smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1[nH+]ccn1-c1ccccc1CNC(=O)[C@H]1CCC[N@@H+](C)C1	ZINC000216914370	402290114	/nfs/dbraw/zinc/29/01/14/402290114.db2.gz	KUAJQPAVPGJFLP-INIZCTEOSA-N	2	1	312.417	2.139	40	70		DEIBMP
Cc1[nH+]ccn1-c1ccccc1CNC(=O)[C@H]1CCC[N@H+](C)C1	ZINC000216914370	402290116	/nfs/dbraw/zinc/29/01/16/402290116.db2.gz	KUAJQPAVPGJFLP-INIZCTEOSA-N	2	1	312.417	2.139	40	70		DEIBMP
CC[C@@H]1CCCC[N@H+]1CCCNC(=O)CC1CC[NH+](C)CC1	ZINC000216899259	402289948	/nfs/dbraw/zinc/28/99/48/402289948.db2.gz	DVXPJXWWYHCBFD-QGZVFWFLSA-N	2	1	309.498	2.489	40	70		DEIBMP
Cc1[nH+]ccn1-c1ccccc1CNC(=O)[C@@H]1CCC[N@@H+](C)C1	ZINC000216914342	402290309	/nfs/dbraw/zinc/29/03/09/402290309.db2.gz	KUAJQPAVPGJFLP-MRXNPFEDSA-N	2	1	312.417	2.139	40	70		DEIBMP
Cc1[nH+]ccn1-c1ccccc1CNC(=O)[C@@H]1CCC[N@H+](C)C1	ZINC000216914342	402290311	/nfs/dbraw/zinc/29/03/11/402290311.db2.gz	KUAJQPAVPGJFLP-MRXNPFEDSA-N	2	1	312.417	2.139	40	70		DEIBMP
C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)CC2CC[NH+](C)CC2)C1	ZINC000216899102	402290265	/nfs/dbraw/zinc/29/02/65/402290265.db2.gz	LUBOKIDPKMKXBF-IYBDPMFKSA-N	2	1	309.498	2.203	40	70		DEIBMP
CC[C@H]1CCCC[N@H+]1CCCNC(=O)CC1CC[NH+](C)CC1	ZINC000216899294	257232794	/nfs/dbraw/zinc/23/27/94/257232794.db2.gz	DVXPJXWWYHCBFD-KRWDZBQOSA-N	2	1	309.498	2.489	40	70		DEIBMP
Cc1[nH+]ccn1-c1ccc(CNC(=O)C2CC[NH+](C)CC2)cc1	ZINC000216922773	402289925	/nfs/dbraw/zinc/28/99/25/402289925.db2.gz	VAAHLELBVMOPOY-UHFFFAOYSA-N	2	1	312.417	2.139	40	70		DEIBMP
Cc1[nH+]ccn1-c1ccccc1CNC(=O)C1CC[NH+](C)CC1	ZINC000216922738	402290032	/nfs/dbraw/zinc/29/00/32/402290032.db2.gz	LKBIBSCLDTZLRE-UHFFFAOYSA-N	2	1	312.417	2.139	40	70		DEIBMP