smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1nc(C[N@@H+]2CCCC23CCN(c2cc(C)c4cccc(C)c4[nH+]2)CC3)cs1	ZINC001164692279	719804753	/nfs/dbraw/zinc/80/47/53/719804753.db2.gz	MHUKCHZIBVQEEV-UHFFFAOYSA-N	2	2	406.599	5.252	20	0		HKADLP
Cc1nc(C[N@H+]2CCCC23CCN(c2cc(C)c4cccc(C)c4[nH+]2)CC3)cs1	ZINC001164692279	719804755	/nfs/dbraw/zinc/80/47/55/719804755.db2.gz	MHUKCHZIBVQEEV-UHFFFAOYSA-N	2	2	406.599	5.252	20	0		HKADLP
C[N@H+](Cc1ccncc1)C1CC2(C1)CCN(c1[nH+]ccc3cc(Cl)ccc31)CC2	ZINC001164792613	721493325	/nfs/dbraw/zinc/49/33/25/721493325.db2.gz	SFPQCIYMNLBYSB-UHFFFAOYSA-N	2	2	406.961	5.164	20	0		HKADLP
C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1[nH+]ccc3cc(Cl)ccc31)CC2	ZINC001164792613	721493327	/nfs/dbraw/zinc/49/33/27/721493327.db2.gz	SFPQCIYMNLBYSB-UHFFFAOYSA-N	2	2	406.961	5.164	20	0		HKADLP
Cc1cc(N2CCC3(CC([N@H+](C)Cc4ccncc4)C3)CC2)[nH+]c2c(C)cccc12	ZINC001164793141	721490493	/nfs/dbraw/zinc/49/04/93/721490493.db2.gz	OBJXOWJKPAUYDY-UHFFFAOYSA-N	2	2	400.570	5.128	20	0		HKADLP
Cc1cc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)[nH+]c2c(C)cccc12	ZINC001164793141	721490495	/nfs/dbraw/zinc/49/04/95/721490495.db2.gz	OBJXOWJKPAUYDY-UHFFFAOYSA-N	2	2	400.570	5.128	20	0		HKADLP
Cc1nc(N2CCC3(CC([N@H+](C)Cc4ccncc4)C3)CC2)cc(C2CCCCC2)[nH+]1	ZINC001164796760	721499479	/nfs/dbraw/zinc/49/94/79/721499479.db2.gz	WZEWIQAMJDZKPE-UHFFFAOYSA-N	2	2	419.617	5.109	20	0		HKADLP
Cc1nc(N2CCC3(CC([N@@H+](C)Cc4ccncc4)C3)CC2)cc(C2CCCCC2)[nH+]1	ZINC001164796760	721499482	/nfs/dbraw/zinc/49/94/82/721499482.db2.gz	WZEWIQAMJDZKPE-UHFFFAOYSA-N	2	2	419.617	5.109	20	0		HKADLP
C[N@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1cc(-c3ccccc3)cc[nH+]1)CC2	ZINC001164842460	720677228	/nfs/dbraw/zinc/67/72/28/720677228.db2.gz	RRBCRBOSNFQRTR-RUZDIDTESA-N	2	2	413.565	5.009	20	0		HKADLP
C[N@@H+](Cc1ccccc1)[C@H]1COC2(C1)CCN(c1cc(-c3ccccc3)cc[nH+]1)CC2	ZINC001164842460	720677235	/nfs/dbraw/zinc/67/72/35/720677235.db2.gz	RRBCRBOSNFQRTR-RUZDIDTESA-N	2	2	413.565	5.009	20	0		HKADLP
C[N@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1cc(-c3ccccc3)cc[nH+]1)CC2	ZINC001164842466	720676356	/nfs/dbraw/zinc/67/63/56/720676356.db2.gz	RRBCRBOSNFQRTR-VWLOTQADSA-N	2	2	413.565	5.009	20	0		HKADLP
C[N@@H+](Cc1ccccc1)[C@@H]1COC2(C1)CCN(c1cc(-c3ccccc3)cc[nH+]1)CC2	ZINC001164842466	720676362	/nfs/dbraw/zinc/67/63/62/720676362.db2.gz	RRBCRBOSNFQRTR-VWLOTQADSA-N	2	2	413.565	5.009	20	0		HKADLP
C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3[nH+]ccc4cc(Cl)ccc43)C[C@H]21	ZINC001165027232	721807998	/nfs/dbraw/zinc/80/79/98/721807998.db2.gz	USHCPTRMOIFZRB-CDNPAEQRSA-N	2	2	406.961	5.020	20	0		HKADLP
C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3[nH+]ccc4cc(Cl)ccc43)C[C@H]21	ZINC001165027232	721807999	/nfs/dbraw/zinc/80/79/99/721807999.db2.gz	USHCPTRMOIFZRB-CDNPAEQRSA-N	2	2	406.961	5.020	20	0		HKADLP
C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3[nH+]ccc4cc(Cl)ccc43)C[C@@H]21	ZINC001165027233	721808241	/nfs/dbraw/zinc/80/82/41/721808241.db2.gz	USHCPTRMOIFZRB-OFAXGOBFSA-N	2	2	406.961	5.020	20	0		HKADLP
C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@H]2CN(c3[nH+]ccc4cc(Cl)ccc43)C[C@@H]21	ZINC001165027233	721808242	/nfs/dbraw/zinc/80/82/42/721808242.db2.gz	USHCPTRMOIFZRB-OFAXGOBFSA-N	2	2	406.961	5.020	20	0		HKADLP
C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3[nH+]ccc4cc(Cl)ccc43)C[C@H]21	ZINC001165027234	721808189	/nfs/dbraw/zinc/80/81/89/721808189.db2.gz	USHCPTRMOIFZRB-SXSPYAJSSA-N	2	2	406.961	5.020	20	0		HKADLP
C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3[nH+]ccc4cc(Cl)ccc43)C[C@H]21	ZINC001165027234	721808190	/nfs/dbraw/zinc/80/81/90/721808190.db2.gz	USHCPTRMOIFZRB-SXSPYAJSSA-N	2	2	406.961	5.020	20	0		HKADLP
C[N@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3[nH+]ccc4cc(Cl)ccc43)C[C@@H]21	ZINC001165027235	721808089	/nfs/dbraw/zinc/80/80/89/721808089.db2.gz	USHCPTRMOIFZRB-YFXJRYMSSA-N	2	2	406.961	5.020	20	0		HKADLP
C[N@@H+](Cc1ccccn1)[C@@H]1CCC[C@@H]2CN(c3[nH+]ccc4cc(Cl)ccc43)C[C@@H]21	ZINC001165027235	721808092	/nfs/dbraw/zinc/80/80/92/721808092.db2.gz	USHCPTRMOIFZRB-YFXJRYMSSA-N	2	2	406.961	5.020	20	0		HKADLP