smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cn1cnc2c1[C@H](COCCN1CCOCC1)CN(c1ncccc1NC(=O)CCl)C2	ZINC001164833047	720469544	/nfs/dbraw/zinc/46/95/44/720469544.db2.gz	XGPZTOYBTDGZKY-INIZCTEOSA-N	0	0	448.955	1.445	20	50		IDGDRN
Cn1cnc2c1[C@@H](COCCN1CCOCC1)CN(c1ccc(NC(=O)CCl)cn1)C2	ZINC001164835039	720477495	/nfs/dbraw/zinc/47/74/95/720477495.db2.gz	WBCMAQJFTFORBB-MRXNPFEDSA-N	0	0	448.955	1.445	20	50		IDGDRN
O=C(CCl)Nc1cccnc1N1CCO[C@@]2(C1)COCCN(Cc1cccnc1)C2	ZINC001164914938	721793075	/nfs/dbraw/zinc/79/30/75/721793075.db2.gz	RMKVPPIGIPFBBT-NRFANRHFSA-N	0	0	431.924	1.762	20	50		IDGDRN
Cn1cnc2c1[C@H](COCCN1CCOCC1)CN(c1ccc(NC(=O)CCl)cn1)C2	ZINC001164835038	720478536	/nfs/dbraw/zinc/47/85/36/720478536.db2.gz	WBCMAQJFTFORBB-INIZCTEOSA-N	0	0	448.955	1.445	20	50		IDGDRN
O=C(CCl)Nc1cccnc1N1CCO[C@]2(C1)COCCN(Cc1cccnc1)C2	ZINC001164914939	721793420	/nfs/dbraw/zinc/79/34/20/721793420.db2.gz	RMKVPPIGIPFBBT-OAQYLSRUSA-N	0	0	431.924	1.762	20	50		IDGDRN
O=C(CCl)Nc1ccc(N2CCO[C@@]3(C2)COCCN(Cc2cccnc2)C3)nc1	ZINC001164915694	721798504	/nfs/dbraw/zinc/79/85/04/721798504.db2.gz	YBVVUPDKRIQGBP-NRFANRHFSA-N	0	0	431.924	1.762	20	50		IDGDRN
Cn1cnc2c1[C@@H](COCCN1CCOCC1)CN(c1ncccc1NC(=O)CCl)C2	ZINC001164833048	720469832	/nfs/dbraw/zinc/46/98/32/720469832.db2.gz	XGPZTOYBTDGZKY-MRXNPFEDSA-N	0	0	448.955	1.445	20	50		IDGDRN
O=C(CCl)Nc1ccc(N2CCO[C@]3(C2)COCCN(Cc2cccnc2)C3)nc1	ZINC001164915695	721798231	/nfs/dbraw/zinc/79/82/31/721798231.db2.gz	YBVVUPDKRIQGBP-OAQYLSRUSA-N	0	0	431.924	1.762	20	50		IDGDRN