smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCC(CC)C[N@@H+]1CC[C@H]([C@@H](C)N)C1	160575313	486976218	/nfs/dbraw/zinc/97/62/18/486976218.db2.gz	GUFMCBTZCXNZLB-PWSUYJOCSA-N	1	3	198.354	2.092	20	70		AEIDHO
CCC(CC)C[N@H+]1CC[C@H]([C@@H](C)N)C1	160575313	486976224	/nfs/dbraw/zinc/97/62/24/486976224.db2.gz	GUFMCBTZCXNZLB-PWSUYJOCSA-N	1	3	198.354	2.092	20	70		AEIDHO
CCC(CC)C[N@@H+]1CC[C@@H]([C@@H](C)N)C1	160575442	486976293	/nfs/dbraw/zinc/97/62/93/486976293.db2.gz	GUFMCBTZCXNZLB-ZYHUDNBSSA-N	1	3	198.354	2.092	20	70		AEIDHO
CCC(CC)C[N@H+]1CC[C@@H]([C@@H](C)N)C1	160575442	486976297	/nfs/dbraw/zinc/97/62/97/486976297.db2.gz	GUFMCBTZCXNZLB-ZYHUDNBSSA-N	1	3	198.354	2.092	20	70		AEIDHO
C[C@H](N)[C@@H]1CC[N@H+](CCC(C)(C)C)C1	160573246	486976429	/nfs/dbraw/zinc/97/64/29/486976429.db2.gz	RLKATGDXMOIGFX-WDEREUQCSA-N	1	3	198.354	2.092	20	70		AEIDHO
C[C@H](N)[C@@H]1CC[N@@H+](CCC(C)(C)C)C1	160573246	486976433	/nfs/dbraw/zinc/97/64/33/486976433.db2.gz	RLKATGDXMOIGFX-WDEREUQCSA-N	1	3	198.354	2.092	20	70		AEIDHO
C[C@@H](N)[C@@H]1CC[N@H+](CCC(C)(C)C)C1	160573362	486976524	/nfs/dbraw/zinc/97/65/24/486976524.db2.gz	RLKATGDXMOIGFX-GHMZBOCLSA-N	1	3	198.354	2.092	20	70		AEIDHO
C[C@@H](N)[C@@H]1CC[N@@H+](CCC(C)(C)C)C1	160573362	486976529	/nfs/dbraw/zinc/97/65/29/486976529.db2.gz	RLKATGDXMOIGFX-GHMZBOCLSA-N	1	3	198.354	2.092	20	70		AEIDHO
C[C@@H](N)[C@H]1CC[N@H+](CCC(C)(C)C)C1	160573631	486976599	/nfs/dbraw/zinc/97/65/99/486976599.db2.gz	RLKATGDXMOIGFX-MNOVXSKESA-N	1	3	198.354	2.092	20	70		AEIDHO
C[C@@H](N)[C@H]1CC[N@@H+](CCC(C)(C)C)C1	160573631	486976603	/nfs/dbraw/zinc/97/66/03/486976603.db2.gz	RLKATGDXMOIGFX-MNOVXSKESA-N	1	3	198.354	2.092	20	70		AEIDHO
C[C@H](N)[C@H]1CC[N@H+](CCC(C)(C)C)C1	160573493	486976673	/nfs/dbraw/zinc/97/66/73/486976673.db2.gz	RLKATGDXMOIGFX-QWRGUYRKSA-N	1	3	198.354	2.092	20	70		AEIDHO
C[C@H](N)[C@H]1CC[N@@H+](CCC(C)(C)C)C1	160573493	486976679	/nfs/dbraw/zinc/97/66/79/486976679.db2.gz	RLKATGDXMOIGFX-QWRGUYRKSA-N	1	3	198.354	2.092	20	70		AEIDHO
CCCC[C@@H](C)[NH2+][C@H]1CCCNCC1	160677139	486977254	/nfs/dbraw/zinc/97/72/54/486977254.db2.gz	USIIXLHVMSNBTR-NEPJUHHUSA-N	1	3	198.354	2.297	20	70		AEIDHO
CC(C)CCC[NH2+][C@H]1CCCNCC1	160670157	486977269	/nfs/dbraw/zinc/97/72/69/486977269.db2.gz	ILZPHOMXDKZCQO-LBPRGKRZSA-N	1	3	198.354	2.154	20	70		AEIDHO
CCC[C@H](CC)[NH2+][C@H]1CCCNCC1	160676728	486977382	/nfs/dbraw/zinc/97/73/82/486977382.db2.gz	QQZZAMMMMZMBAU-RYUDHWBXSA-N	1	3	198.354	2.297	20	70		AEIDHO
CCC[C@H](CC)[NH2+][C@@H]1CCCNCC1	160676507	486977450	/nfs/dbraw/zinc/97/74/50/486977450.db2.gz	QQZZAMMMMZMBAU-NWDGAFQWSA-N	1	3	198.354	2.297	20	70		AEIDHO
CCC[C@@H](CC)[NH2+][C@H]1CCCNCC1	160676624	486977575	/nfs/dbraw/zinc/97/75/75/486977575.db2.gz	QQZZAMMMMZMBAU-NEPJUHHUSA-N	1	3	198.354	2.297	20	70		AEIDHO
CCC[C@@H](CC)[NH2+][C@@H]1CCCNCC1	160676374	486977661	/nfs/dbraw/zinc/97/76/61/486977661.db2.gz	QQZZAMMMMZMBAU-VXGBXAGGSA-N	1	3	198.354	2.297	20	70		AEIDHO
CC[C@H]([NH2+][C@@H]1CCCNCC1)C(C)C	160672720	486977672	/nfs/dbraw/zinc/97/76/72/486977672.db2.gz	HTYHMZUWTLQDDC-NEPJUHHUSA-N	1	3	198.354	2.153	20	70		AEIDHO
CC(C)CCC[NH2+][C@@H]1CCCNCC1	160670029	486977845	/nfs/dbraw/zinc/97/78/45/486977845.db2.gz	ILZPHOMXDKZCQO-GFCCVEGCSA-N	1	3	198.354	2.154	20	70		AEIDHO
CCCC[C@H](C)[NH2+][C@H]1CCCNCC1	160677235	486977933	/nfs/dbraw/zinc/97/79/33/486977933.db2.gz	USIIXLHVMSNBTR-RYUDHWBXSA-N	1	3	198.354	2.297	20	70		AEIDHO
CC[C@H]([NH2+][C@H]1CCCNCC1)C(C)C	160672962	486977982	/nfs/dbraw/zinc/97/79/82/486977982.db2.gz	HTYHMZUWTLQDDC-RYUDHWBXSA-N	1	3	198.354	2.153	20	70		AEIDHO
CC[C@@H]([NH2+][C@@H]1CCCNCC1)C(C)C	160672848	486977993	/nfs/dbraw/zinc/97/79/93/486977993.db2.gz	HTYHMZUWTLQDDC-VXGBXAGGSA-N	1	3	198.354	2.153	20	70		AEIDHO
CCCC[C@H](C)[NH2+][C@@H]1CCCNCC1	160677006	486978012	/nfs/dbraw/zinc/97/80/12/486978012.db2.gz	USIIXLHVMSNBTR-NWDGAFQWSA-N	1	3	198.354	2.297	20	70		AEIDHO
CC[C@@H]([NH2+][C@H]1CCCNCC1)C(C)C	160673087	486978037	/nfs/dbraw/zinc/97/80/37/486978037.db2.gz	HTYHMZUWTLQDDC-NWDGAFQWSA-N	1	3	198.354	2.153	20	70		AEIDHO
CCCC[C@@H](C)[NH2+][C@@H]1CCCNCC1	160676894	486978055	/nfs/dbraw/zinc/97/80/55/486978055.db2.gz	USIIXLHVMSNBTR-VXGBXAGGSA-N	1	3	198.354	2.297	20	70		AEIDHO
CC[NH2+]CCNCC1CCCCCC1	161298832	486979578	/nfs/dbraw/zinc/97/95/78/486979578.db2.gz	QEOINGRVZFTAOY-UHFFFAOYSA-N	1	3	198.354	2.156	20	70		AEIDHO
CCC[NH2+]CCNCC(CC)CC	161339462	486980327	/nfs/dbraw/zinc/98/03/27/486980327.db2.gz	AHIVITBUGRWJFW-UHFFFAOYSA-N	1	3	186.343	2.012	20	70		AEIDHO
CC(C)(C)CCC[N@@H+]1CCC[C@@H](N)C1	217844142	487028224	/nfs/dbraw/zinc/02/82/24/487028224.db2.gz	VYEYNBGKJPWRNM-LLVKDONJSA-N	1	3	198.354	2.236	20	70		AEIDHO
CC(C)(C)CCC[N@H+]1CCC[C@@H](N)C1	217844142	487028229	/nfs/dbraw/zinc/02/82/29/487028229.db2.gz	VYEYNBGKJPWRNM-LLVKDONJSA-N	1	3	198.354	2.236	20	70		AEIDHO
CC(C)CCCN1CC[C@@H]([NH3+])[C@@H](C)C1	217975507	487029007	/nfs/dbraw/zinc/02/90/07/487029007.db2.gz	UPFIQEOEGYXBAZ-NWDGAFQWSA-N	1	3	198.354	2.092	20	70		AEIDHO
CC(C)CCC[N@@H+]1CC[C@@H](N)[C@@H](C)C1	217975507	487029008	/nfs/dbraw/zinc/02/90/08/487029008.db2.gz	UPFIQEOEGYXBAZ-NWDGAFQWSA-N	1	3	198.354	2.092	20	70		AEIDHO
CC(C)CCC[N@H+]1CC[C@@H](N)[C@@H](C)C1	217975507	487029013	/nfs/dbraw/zinc/02/90/13/487029013.db2.gz	UPFIQEOEGYXBAZ-NWDGAFQWSA-N	1	3	198.354	2.092	20	70		AEIDHO