smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+]=C(NCC1(N(C)C)CCCC1)N[C@@H]1C[N@@H+](C(C)C)C[C@@H]1C	ZINC000261948095	222263335	/nfs/dbraw/zinc/26/33/35/222263335.db2.gz	GLZDCKZJLSSQMG-JKSUJKDBSA-N	2	3	323.529	1.755	10	30		DDEEHP
C[NH+]=C(NCC1(N(C)C)CCCC1)N[C@@H]1C[N@H+](C(C)C)C[C@@H]1C	ZINC000261948095	222263339	/nfs/dbraw/zinc/26/33/39/222263339.db2.gz	GLZDCKZJLSSQMG-JKSUJKDBSA-N	2	3	323.529	1.755	10	30		DDEEHP
CC[NH+]=C(NC[C@@H]1CC[N@H+](C)C1)N[C@H]1CCN(C2CCCC2)C1	ZINC000262790897	222294301	/nfs/dbraw/zinc/29/43/01/222294301.db2.gz	NEEPFDHQFRHKIQ-HOTGVXAUSA-N	2	3	321.513	1.510	10	30		DDEEHP
CC[NH+]=C(NC[C@@H]1CC[N@@H+](C)C1)N[C@H]1CCN(C2CCCC2)C1	ZINC000262790897	222294304	/nfs/dbraw/zinc/29/43/04/222294304.db2.gz	NEEPFDHQFRHKIQ-HOTGVXAUSA-N	2	3	321.513	1.510	10	30		DDEEHP
C[NH+]=C(NC[C@@H]1CC[N@H+](C)C1)N[C@@H]1CCN(C2CCCC2)C1	ZINC000262869245	222298358	/nfs/dbraw/zinc/29/83/58/222298358.db2.gz	CQADZWHHZZQVRR-LSDHHAIUSA-N	2	3	307.486	1.120	10	30		DDEEHP
C[NH+]=C(NC[C@@H]1CC[N@@H+](C)C1)N[C@@H]1CCN(C2CCCC2)C1	ZINC000262869245	222298360	/nfs/dbraw/zinc/29/83/60/222298360.db2.gz	CQADZWHHZZQVRR-LSDHHAIUSA-N	2	3	307.486	1.120	10	30		DDEEHP
C[NH+]=C(NC[C@@H]1CC[N@H+](C)C1)N[C@H]1CCN(C2CCCC2)C1	ZINC000262869243	222298168	/nfs/dbraw/zinc/29/81/68/222298168.db2.gz	CQADZWHHZZQVRR-GJZGRUSLSA-N	2	3	307.486	1.120	10	30		DDEEHP
C[NH+]=C(NC[C@@H]1CC[N@@H+](C)C1)N[C@H]1CCN(C2CCCC2)C1	ZINC000262869243	222298170	/nfs/dbraw/zinc/29/81/70/222298170.db2.gz	CQADZWHHZZQVRR-GJZGRUSLSA-N	2	3	307.486	1.120	10	30		DDEEHP
CCN1CCC[C@@H]1CNC(N[C@@H]1C[N@@H+](C(C)C)C[C@H]1C)=[NH+]C	ZINC000261988776	279303639	/nfs/dbraw/zinc/30/36/39/279303639.db2.gz	QTQSVUBRBAHMCE-BZUAXINKSA-N	2	3	309.502	1.364	10	30		DDEEHP
CCN1CCC[C@@H]1CNC(N[C@@H]1C[N@H+](C(C)C)C[C@H]1C)=[NH+]C	ZINC000261988776	279303640	/nfs/dbraw/zinc/30/36/40/279303640.db2.gz	QTQSVUBRBAHMCE-BZUAXINKSA-N	2	3	309.502	1.364	10	30		DDEEHP
CC[NH+]=C(NC[C@@H]1CC[N@H+](C)C1)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000245584930	698335465	/nfs/dbraw/zinc/33/54/65/698335465.db2.gz	DPPWYZLLVHMJSB-OWCLPIDISA-N	2	3	309.502	1.222	10	30		DDEEHP
CC[NH+]=C(NC[C@@H]1CC[N@@H+](C)C1)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000245584930	698335471	/nfs/dbraw/zinc/33/54/71/698335471.db2.gz	DPPWYZLLVHMJSB-OWCLPIDISA-N	2	3	309.502	1.222	10	30		DDEEHP
N=C(NC(=[NH2+])NCCCCCC[NH3+])Nc1ccc(Cl)cc1	ZINC000196388109	354299144	/nfs/dbraw/zinc/29/91/44/354299144.db2.gz	NOIUSXTZNNFUKD-UHFFFAOYSA-N	2	3	310.833	1.900	10	30		DDEEHP
C[NH+]=C(NCC1(N(C)C)CCCC1)N[C@@H]1C[N@@H+](C(C)C)C[C@H]1C	ZINC000261948093	222263457	/nfs/dbraw/zinc/26/34/57/222263457.db2.gz	GLZDCKZJLSSQMG-HZPDHXFCSA-N	2	3	323.529	1.755	10	30		DDEEHP
C[NH+]=C(NCC1(N(C)C)CCCC1)N[C@@H]1C[N@H+](C(C)C)C[C@H]1C	ZINC000261948093	222263459	/nfs/dbraw/zinc/26/34/59/222263459.db2.gz	GLZDCKZJLSSQMG-HZPDHXFCSA-N	2	3	323.529	1.755	10	30		DDEEHP
CCN1CCC[C@@H]1CNC(N[C@@H]1C[N@@H+](C(C)C)C[C@@H]1C)=[NH+]C	ZINC000158258853	279303590	/nfs/dbraw/zinc/30/35/90/279303590.db2.gz	QTQSVUBRBAHMCE-ARFHVFGLSA-N	2	3	309.502	1.364	10	30		DDEEHP
CCN1CCC[C@@H]1CNC(N[C@@H]1C[N@H+](C(C)C)C[C@@H]1C)=[NH+]C	ZINC000158258853	279303592	/nfs/dbraw/zinc/30/35/92/279303592.db2.gz	QTQSVUBRBAHMCE-ARFHVFGLSA-N	2	3	309.502	1.364	10	30		DDEEHP