smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@@H]1C	ZINC000159942092	545993479	/nfs/dbraw/zinc/99/34/79/545993479.db2.gz	IDKYZTZSRQAXAP-UMGGQSCQSA-N	1	3	356.514	2.385	10	70		FEIEHO
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1C[C@@H]2CCC[N@H+]2C[C@@H]1C	ZINC000159942092	545993483	/nfs/dbraw/zinc/99/34/83/545993483.db2.gz	IDKYZTZSRQAXAP-UMGGQSCQSA-N	1	3	356.514	2.385	10	70		FEIEHO
CCC[C@@H](C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)[NH+](C)C	ZINC000159880330	545988323	/nfs/dbraw/zinc/98/83/23/545988323.db2.gz	AUBSNJJPWDWORO-VQTJNVASSA-N	1	3	360.546	2.212	10	70		FEIEHO
CC(C)[N@H+]1C[C@H](NC(=O)CCN2CCN(c3ccccc3)CC2)[C@@H](C)C1	ZINC000161329809	546120139	/nfs/dbraw/zinc/12/01/39/546120139.db2.gz	XPUFVUPZWNASEJ-ICSRJNTNSA-N	1	3	358.530	2.044	10	70		FEIEHO
CC(C)[N@@H+]1C[C@H](NC(=O)CCN2CCN(c3ccccc3)CC2)[C@@H](C)C1	ZINC000161329809	546120143	/nfs/dbraw/zinc/12/01/43/546120143.db2.gz	XPUFVUPZWNASEJ-ICSRJNTNSA-N	1	3	358.530	2.044	10	70		FEIEHO
CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)CCN2CCN(c3ccccc3)CC2)C1	ZINC000161329694	546119987	/nfs/dbraw/zinc/11/99/87/546119987.db2.gz	XPUFVUPZWNASEJ-QUCCMNQESA-N	1	3	358.530	2.044	10	70		FEIEHO
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)CCN2CCN(c3ccccc3)CC2)C1	ZINC000161329694	546119989	/nfs/dbraw/zinc/11/99/89/546119989.db2.gz	XPUFVUPZWNASEJ-QUCCMNQESA-N	1	3	358.530	2.044	10	70		FEIEHO
CCN1CCN(c2ccc(C(=O)N[C@H]3C[N@@H+](C(C)C)C[C@@H]3C)cc2)CC1	ZINC000161372756	546124879	/nfs/dbraw/zinc/12/48/79/546124879.db2.gz	NGZIYUVXZPIGBF-PXNSSMCTSA-N	1	3	358.530	2.287	10	70		FEIEHO
CCN1CCN(c2ccc(C(=O)N[C@H]3C[N@H+](C(C)C)C[C@@H]3C)cc2)CC1	ZINC000161372756	546124885	/nfs/dbraw/zinc/12/48/85/546124885.db2.gz	NGZIYUVXZPIGBF-PXNSSMCTSA-N	1	3	358.530	2.287	10	70		FEIEHO
CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C1	ZINC000161351631	546122232	/nfs/dbraw/zinc/12/22/32/546122232.db2.gz	BFOVYWITFCFSCN-CTNGQTDRSA-N	1	3	372.557	2.434	10	70		FEIEHO
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)C1	ZINC000161351631	546122235	/nfs/dbraw/zinc/12/22/35/546122235.db2.gz	BFOVYWITFCFSCN-CTNGQTDRSA-N	1	3	372.557	2.434	10	70		FEIEHO
CN(CCN(C)Cc1ccc(F)cc1)CC[N@H+](C)C1CCN(C)CC1	ZINC000161179512	546106935	/nfs/dbraw/zinc/10/69/35/546106935.db2.gz	UEQHHTKMVJJFOZ-UHFFFAOYSA-N	1	3	350.526	2.215	10	70		FEIEHO
CN(CCN(C)Cc1ccc(F)cc1)CC[N@@H+](C)C1CCN(C)CC1	ZINC000161179512	546106939	/nfs/dbraw/zinc/10/69/39/546106939.db2.gz	UEQHHTKMVJJFOZ-UHFFFAOYSA-N	1	3	350.526	2.215	10	70		FEIEHO
CCN1CCN(c2ccc(C(=O)N[C@@H]3C[N@@H+](C(C)C)C[C@@H]3C)cc2)CC1	ZINC000161372645	546124602	/nfs/dbraw/zinc/12/46/02/546124602.db2.gz	NGZIYUVXZPIGBF-FXAWDEMLSA-N	1	3	358.530	2.287	10	70		FEIEHO
CCN1CCN(c2ccc(C(=O)N[C@@H]3C[N@H+](C(C)C)C[C@@H]3C)cc2)CC1	ZINC000161372645	546124608	/nfs/dbraw/zinc/12/46/08/546124608.db2.gz	NGZIYUVXZPIGBF-FXAWDEMLSA-N	1	3	358.530	2.287	10	70		FEIEHO
CCC[C@H](C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1)[NH+](C)C	ZINC000159880457	545988387	/nfs/dbraw/zinc/98/83/87/545988387.db2.gz	AUBSNJJPWDWORO-WOJBJXKFSA-N	1	3	360.546	2.212	10	70		FEIEHO
CC(C)[N@H+]1C[C@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)[C@@H](C)C1	ZINC000161351761	546122317	/nfs/dbraw/zinc/12/23/17/546122317.db2.gz	BFOVYWITFCFSCN-FPOVZHCZSA-N	1	3	372.557	2.434	10	70		FEIEHO
CC(C)[N@@H+]1C[C@H](NC(=O)CCCN2CCN(c3ccccc3)CC2)[C@@H](C)C1	ZINC000161351761	546122322	/nfs/dbraw/zinc/12/23/22/546122322.db2.gz	BFOVYWITFCFSCN-FPOVZHCZSA-N	1	3	372.557	2.434	10	70		FEIEHO