smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1CCN(c2ccc(CNC[C@H]3C[NH2+]CCCO3)cc2)CC1	ZINC000841087739	671912386	/nfs/dbraw/zinc/91/23/86/671912386.db2.gz	VPNDCGMTGFDEGV-GOSISDBHSA-N	1	3	318.465	0.907	20	10		DCCDHO
N[C@@H](C(=O)N1CCCc2cc(O)c(O)cc2C1)C1CC[NH2+]CC1	ZINC001160924269	772138359	/nfs/dbraw/zinc/13/83/59/772138359.db2.gz	GVSJUIPYQGQJME-MRXNPFEDSA-N	1	3	319.405	0.700	20	10		DCCDHO
CCOC(=O)CN(CCC[NH3+])C(=O)C[C@@H]([NH3+])c1ccccc1[O-]	ZINC001161158553	772178581	/nfs/dbraw/zinc/17/85/81/772178581.db2.gz	WYDVVHWJQGPACG-CYBMUJFWSA-N	1	3	323.393	0.523	20	10		DCCDHO
CN1CCN(c2ccc(CN3CC[C@@H]([NH3+])[C@H](O)C3)cc2)CC1	ZINC001205953237	773035673	/nfs/dbraw/zinc/03/56/73/773035673.db2.gz	POVUAVVUKLAVTI-IAGOWNOFSA-N	1	3	304.438	0.332	20	10		DCCDHO
CN1CCN(c2ccc(CN3CCOC4(C[NH2+]C4)C3)cc2)CC1	ZINC001329996920	950043833	/nfs/dbraw/zinc/04/38/33/950043833.db2.gz	YVKKDROPPAXDAD-UHFFFAOYSA-N	1	3	316.449	0.613	20	10		DCCDHO
CN(C)c1ccc([C@H](CNC(=O)C[C@@H](O)C[NH3+])N(C)C)cc1	ZINC001342295096	953282188	/nfs/dbraw/zinc/28/21/88/953282188.db2.gz	ZOKXJELTSFWJHS-CABCVRRESA-N	1	3	308.426	0.181	20	10		DCCDHO
CCOC(=O)C1=C(NC(=O)C[C@@H]([NH3+])c2ccccc2[O-])C[NH2+]C1	ZINC001220830035	774928707	/nfs/dbraw/zinc/92/87/07/774928707.db2.gz	LCFYIRGGAUWXFI-GFCCVEGCSA-N	1	3	319.361	0.319	20	10		DCCDHO
Nc1ccc(CN2CC[C@@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)cc1	ZINC001337838946	952921140	/nfs/dbraw/zinc/92/11/40/952921140.db2.gz	WCCMXLCVWLNTRJ-KFWWJZLASA-N	1	3	302.378	0.636	20	10		DCCDHO
N[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCS(=O)(=O)CC2)cc1	ZINC000854221570	670536233	/nfs/dbraw/zinc/53/62/33/670536233.db2.gz	PKORXHMDNHLZLB-CVEARBPZSA-N	1	3	323.462	0.891	20	10		DCCDHO
c1cc(N2CC[NH2+]CC2)ccc1O[C@H]1CC[C@@H]2NCCO[C@@H]21	ZINC001218120829	774213185	/nfs/dbraw/zinc/21/31/85/774213185.db2.gz	VSVMOGDBKIQXLH-ULQDDVLXSA-N	1	3	303.406	0.994	20	10		DCCDHO
CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2OCC[C@@H]2[NH3+])N(C)C)cc1	ZINC001341512711	953234782	/nfs/dbraw/zinc/23/47/82/953234782.db2.gz	LPGOGVUNDGBCLX-ARFHVFGLSA-N	1	3	320.437	0.588	20	10		DCCDHO
O=C1O[C@H]2C[NH2+]C[C@H]2N1[C@H]1CC[N@@H+](Cc2ccccc2[O-])C1	ZINC000872255204	667883103	/nfs/dbraw/zinc/88/31/03/667883103.db2.gz	RDBMCDGBLOJURQ-GUTXKFCHSA-N	1	3	303.362	0.759	20	10		DCCDHO
O=C1O[C@H]2C[NH2+]C[C@H]2N1[C@H]1CC[N@H+](Cc2ccccc2[O-])C1	ZINC000872255204	667883106	/nfs/dbraw/zinc/88/31/06/667883106.db2.gz	RDBMCDGBLOJURQ-GUTXKFCHSA-N	1	3	303.362	0.759	20	10		DCCDHO
CN(Cc1ccc(N2CCOCC2)cc1)[C@H]1C[C@H]([NH3+])C[C@@H]1O	ZINC000923319202	667504449	/nfs/dbraw/zinc/50/44/49/667504449.db2.gz	MMHKYWISXZWHOA-XIRDDKMYSA-N	1	3	305.422	0.806	20	10		DCCDHO
COCC[C@H]([NH3+])C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001514582412	1016980546	/nfs/dbraw/zinc/98/05/46/1016980546.db2.gz	SVAKFSNJYBGDNP-JKSUJKDBSA-N	1	3	322.453	0.835	20	10		DCCDHO
CN(C)c1ccc([C@@H](CNC(=O)N(C)CC[NH3+])N(C)C)cc1	ZINC001262601397	947738618	/nfs/dbraw/zinc/73/86/18/947738618.db2.gz	CURNPNUZFICYMZ-OAHLLOKOSA-N	1	3	307.442	0.955	20	10		DCCDHO
CN(C)c1ccc([C@H](CNC(=O)[C@H]2[C@@H]3C[NH2+]C[C@@H]32)N(C)C)cc1	ZINC001263260228	947826910	/nfs/dbraw/zinc/82/69/10/947826910.db2.gz	VEYPQAKHODGHOM-VVLHAWIVSA-N	1	3	316.449	0.937	20	10		DCCDHO
[O-]c1cccc(Cl)c1CN1CC[NH2+]CCNCC[NH2+]CC1	ZINC001235868972	769951905	/nfs/dbraw/zinc/95/19/05/769951905.db2.gz	DFSFFZXHJHZAEJ-UHFFFAOYSA-N	1	3	312.845	0.630	20	10		DCCDHO
[NH3+]CCCNC(=O)CN(CCC[NH3+])Cc1cc(F)ccc1[O-]	ZINC001236310585	769993516	/nfs/dbraw/zinc/99/35/16/769993516.db2.gz	HTXAFOSZARATRB-UHFFFAOYSA-N	1	3	312.389	0.147	20	10		DCCDHO
CO[C@H](C[NH3+])CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001341624451	953241443	/nfs/dbraw/zinc/24/14/43/953241443.db2.gz	ZWAGGNPTQGYLHB-JKSUJKDBSA-N	1	3	322.453	0.835	20	10		DCCDHO
CN1CCN(c2ccc(CNC[C@@H]3C[NH2+]CCCO3)cc2)CC1	ZINC000841087740	671912327	/nfs/dbraw/zinc/91/23/27/671912327.db2.gz	VPNDCGMTGFDEGV-SFHVURJKSA-N	1	3	318.465	0.907	20	10		DCCDHO
N[C@H](C(=O)N1CCCc2cc(O)c(O)cc2C1)C1CC[NH2+]CC1	ZINC001160924268	772138607	/nfs/dbraw/zinc/13/86/07/772138607.db2.gz	GVSJUIPYQGQJME-INIZCTEOSA-N	1	3	319.405	0.700	20	10		DCCDHO
COC(=O)[C@@H]1CNCCN1Cc1ccc(N2CC[NH2+]CC2)cc1	ZINC001222413900	775345267	/nfs/dbraw/zinc/34/52/67/775345267.db2.gz	FPFQOXTUZXZTNB-INIZCTEOSA-N	1	3	318.421	0.043	20	10		DCCDHO
CN(C)c1ccc([C@H](CN[C@@H]2C[NH2+]CCOC2)N(C)C)cc1	ZINC000902516378	663417762	/nfs/dbraw/zinc/41/77/62/663417762.db2.gz	CWINBZMMQBIXKR-WBVHZDCISA-N	1	3	306.454	0.933	20	10		DCCDHO
[NH3+][C@H](CC(=O)NC[C@@H]1CC2(C[NH2+]C2)CO1)c1ccccc1[O-]	ZINC001219736870	774594174	/nfs/dbraw/zinc/59/41/74/774594174.db2.gz	KBWZAZVZLUPOEP-WCQYABFASA-N	1	3	305.378	0.277	20	10		DCCDHO
COC(=O)[C@@]1(N)CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)C1	ZINC001236276722	769987087	/nfs/dbraw/zinc/98/70/87/769987087.db2.gz	MKCFRCRHBPWKMY-QGZVFWFLSA-N	1	3	318.421	0.172	20	10		DCCDHO
CCN1CCN(c2ccc(CN3CC[C@@H]([NH3+])[C@H](O)C3)cc2)CC1	ZINC001205958251	773035606	/nfs/dbraw/zinc/03/56/06/773035606.db2.gz	AGMJASLRSAOSEW-QZTJIDSGSA-N	1	3	318.465	0.722	20	10		DCCDHO
Nc1ccc(CN2CC[C@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)cc1	ZINC001337838947	952921172	/nfs/dbraw/zinc/92/11/72/952921172.db2.gz	WCCMXLCVWLNTRJ-ZNMIVQPWSA-N	1	3	302.378	0.636	20	10		DCCDHO
O=C(N1CCc2cccc(O)c2C1)[C@]12C[NH2+]C[C@H]1CNCC2	ZINC001160872009	772130407	/nfs/dbraw/zinc/13/04/07/772130407.db2.gz	FRROOSMKPFZGIX-CXAGYDPISA-N	1	3	301.390	0.476	20	10		DCCDHO
[NH3+][C@H](CC(=O)NC[C@]12C[NH2+]C[C@H]1COC2)c1ccccc1[O-]	ZINC001219813383	774617525	/nfs/dbraw/zinc/61/75/25/774617525.db2.gz	RMGUWPQWDFHCSG-GHJWDPDVSA-N	1	3	305.378	0.134	20	10		DCCDHO
COc1cc([O-])c(C[N@@H+]2CCNC3(CC[NH2+]CC3)C2)c(OC)c1	ZINC001222094827	775267671	/nfs/dbraw/zinc/26/76/71/775267671.db2.gz	KXGKEMTUZVGMRT-UHFFFAOYSA-N	1	3	321.421	0.937	20	10		DCCDHO
COc1cc([O-])c(C[N@H+]2CCNC3(CC[NH2+]CC3)C2)c(OC)c1	ZINC001222094827	775267678	/nfs/dbraw/zinc/26/76/78/775267678.db2.gz	KXGKEMTUZVGMRT-UHFFFAOYSA-N	1	3	321.421	0.937	20	10		DCCDHO
N[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCS(=O)(=O)CC2)cc1	ZINC000854221572	670536176	/nfs/dbraw/zinc/53/61/76/670536176.db2.gz	PKORXHMDNHLZLB-HZPDHXFCSA-N	1	3	323.462	0.891	20	10		DCCDHO
COC(=O)C1(NC(=O)C[C@@H]([NH3+])c2ccccc2[O-])CC[NH2+]CC1	ZINC001220001262	774664657	/nfs/dbraw/zinc/66/46/57/774664657.db2.gz	NYNLCUZULUKKLP-GFCCVEGCSA-N	1	3	321.377	0.194	20	10		DCCDHO
CN(C)c1ccc([C@H](CNC(=O)C[C@H](O)C[NH3+])N(C)C)cc1	ZINC001342295097	953282587	/nfs/dbraw/zinc/28/25/87/953282587.db2.gz	ZOKXJELTSFWJHS-GJZGRUSLSA-N	1	3	308.426	0.181	20	10		DCCDHO
[NH3+]C[C@H]1CN(Cc2cc3c4c(c2O)CCCN4CCC3)C[C@@H]1O	ZINC001206519424	773084211	/nfs/dbraw/zinc/08/42/11/773084211.db2.gz	KZECWDIWNWPNAO-HOCLYGCPSA-N	1	3	317.433	0.842	20	10		DCCDHO
COC(=O)[C@@H]1C[C@H](NCc2ccc(N3CC[NH2+]CC3)cc2)CN1	ZINC001246174981	945354859	/nfs/dbraw/zinc/35/48/59/945354859.db2.gz	QUVCKTAQFZWFDE-HOCLYGCPSA-N	1	3	318.421	0.089	20	10		DCCDHO
CN1CCN(c2ccc(C[NH2+]C[C@H]3CNCCO3)cc2)CC1	ZINC000841099424	671912178	/nfs/dbraw/zinc/91/21/78/671912178.db2.gz	PSFUTIUMKQZPAH-QGZVFWFLSA-N	1	3	304.438	0.516	20	10		DCCDHO
COC(=O)[C@@H]1C[C@@H](NCc2ccc(N3CC[NH2+]CC3)cc2)CN1	ZINC001246174982	945354336	/nfs/dbraw/zinc/35/43/36/945354336.db2.gz	QUVCKTAQFZWFDE-ZBFHGGJFSA-N	1	3	318.421	0.089	20	10		DCCDHO
CN(C)c1ccc([C@H](CN[C@H]2C[NH2+]CCOC2)N(C)C)cc1	ZINC000902516377	663417646	/nfs/dbraw/zinc/41/76/46/663417646.db2.gz	CWINBZMMQBIXKR-RDJZCZTQSA-N	1	3	306.454	0.933	20	10		DCCDHO
[NH3+][C@H](CC(=O)NC[C@H]1OC[C@@H]2CC[NH2+]C[C@@H]21)c1ccccc1[O-]	ZINC001219851764	774627945	/nfs/dbraw/zinc/62/79/45/774627945.db2.gz	DGJAXVMVPMZFJG-YYWXWVFPSA-N	1	3	319.405	0.523	20	10		DCCDHO
CN(C)c1ccc([C@H](CNC(=O)NCC2C[NH2+]C2)N(C)C)cc1	ZINC001336241066	952665991	/nfs/dbraw/zinc/66/59/91/952665991.db2.gz	PAFXMAGOAJXYLD-INIZCTEOSA-N	1	3	319.453	0.874	20	10		DCCDHO
CO[C@@H](C[NH3+])CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001341624448	953241604	/nfs/dbraw/zinc/24/16/04/953241604.db2.gz	ZWAGGNPTQGYLHB-CVEARBPZSA-N	1	3	322.453	0.835	20	10		DCCDHO
CN1CCN(c2ccc(CNC[C@@H]3C[NH2+]CCO3)cc2F)CC1	ZINC001348515773	954337371	/nfs/dbraw/zinc/33/73/71/954337371.db2.gz	PMNJIFMZOPCKTQ-HNNXBMFYSA-N	1	3	322.428	0.656	20	10		DCCDHO
CN1CCN(c2ccc(CNC[C@H]3C[NH2+]CCO3)cc2F)CC1	ZINC001348515774	954337774	/nfs/dbraw/zinc/33/77/74/954337774.db2.gz	PMNJIFMZOPCKTQ-OAHLLOKOSA-N	1	3	322.428	0.656	20	10		DCCDHO
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@H](N)CC(F)F)cc1	ZINC000832272278	671712753	/nfs/dbraw/zinc/71/27/53/671712753.db2.gz	DPYBZPZWDYIXMZ-NEPJUHHUSA-N	1	3	300.353	0.851	20	10		DCCDHO
COC(=O)[C@]1(N)CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)C1	ZINC001236276721	769987958	/nfs/dbraw/zinc/98/79/58/769987958.db2.gz	MKCFRCRHBPWKMY-KRWDZBQOSA-N	1	3	318.421	0.172	20	10		DCCDHO
COCCNCC(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC001341513376	953234665	/nfs/dbraw/zinc/23/46/65/953234665.db2.gz	QHMQWHIZICDNEL-INIZCTEOSA-N	1	3	322.453	0.708	20	10		DCCDHO
CN1CCN(c2ccc(CN3CCC[C@]([NH3+])(CO)C3)cc2)CC1	ZINC000904401393	663512316	/nfs/dbraw/zinc/51/23/16/663512316.db2.gz	HQIAXLBFDXHMRF-GOSISDBHSA-N	1	3	318.465	0.724	20	10		DCCDHO
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@@H](N)CC(F)F)cc1	ZINC000832272280	671712933	/nfs/dbraw/zinc/71/29/33/671712933.db2.gz	DPYBZPZWDYIXMZ-RYUDHWBXSA-N	1	3	300.353	0.851	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@@H+]3C[C@H](O)[C@@H](CO)C3)cc2)CC1	ZINC001140302407	768524453	/nfs/dbraw/zinc/52/44/53/768524453.db2.gz	RFDWDRXIXALLPO-AEFFLSMTSA-N	1	3	319.449	0.614	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@H+]3C[C@H](O)[C@@H](CO)C3)cc2)CC1	ZINC001140302407	768524455	/nfs/dbraw/zinc/52/44/55/768524455.db2.gz	RFDWDRXIXALLPO-AEFFLSMTSA-N	1	3	319.449	0.614	20	10		DCCDHO
COc1cc([O-])c(CN(CC[NH3+])CC[NH3+])c(Br)c1	ZINC001235880769	769958547	/nfs/dbraw/zinc/95/85/47/769958547.db2.gz	OWCVNVFADJLUAO-UHFFFAOYSA-N	1	3	318.215	0.883	20	10		DCCDHO
C[NH+](C)CCN1CCO[C@H]2CN(Cc3ccc(O)cc3O)C[C@@H]21	ZINC001275952954	952557300	/nfs/dbraw/zinc/55/73/00/952557300.db2.gz	QAKNJEHFGQJEHK-RDJZCZTQSA-N	1	3	321.421	0.544	20	10		DCCDHO
CNC(=O)[C@H](CCCC[NH3+])NC(=O)C[C@@H]([NH3+])c1ccccc1[O-]	ZINC001157334908	771589796	/nfs/dbraw/zinc/58/97/96/771589796.db2.gz	AQUJZFUTKHTSTD-OLZOCXBDSA-N	1	3	322.409	0.142	20	10		DCCDHO
[NH3+][C@H](CC(=O)NC[C@H]1CC2(C[NH2+]C2)CO1)c1ccccc1[O-]	ZINC001219736869	774594291	/nfs/dbraw/zinc/59/42/91/774594291.db2.gz	KBWZAZVZLUPOEP-DGCLKSJQSA-N	1	3	305.378	0.277	20	10		DCCDHO
Cc1cc(C)c(CNC(=O)[C@]23C[NH2+]C[C@H]2CNCC3)c(O)c1	ZINC001220825539	774925493	/nfs/dbraw/zinc/92/54/93/774925493.db2.gz	LJNPLMPGVYZDLV-CXAGYDPISA-N	1	3	303.406	0.824	20	10		DCCDHO
CN(C)c1ccc([C@H](CNC(=O)COCC[NH3+])N(C)C)cc1	ZINC001343165922	953326310	/nfs/dbraw/zinc/32/63/10/953326310.db2.gz	MHOWUJUPTKCJMX-HNNXBMFYSA-N	1	3	308.426	0.447	20	10		DCCDHO
COc1cccc([O-])c1C[N@@H+]1CCC[C@@H](C(=O)NCC[NH3+])C1	ZINC000843048170	672056124	/nfs/dbraw/zinc/05/61/24/672056124.db2.gz	ROFLGIOUEJHJNX-GFCCVEGCSA-N	1	3	307.394	0.688	20	10		DCCDHO
COc1cccc([O-])c1C[N@H+]1CCC[C@@H](C(=O)NCC[NH3+])C1	ZINC000843048170	672056127	/nfs/dbraw/zinc/05/61/27/672056127.db2.gz	ROFLGIOUEJHJNX-GFCCVEGCSA-N	1	3	307.394	0.688	20	10		DCCDHO
[NH3+][C@H](CC(=O)N1CC(O)([C@@H]2CCCC[NH2+]2)C1)c1ccccc1[O-]	ZINC001161009507	772148519	/nfs/dbraw/zinc/14/85/19/772148519.db2.gz	WIAHGUGTFDDWDN-HIFRSBDPSA-N	1	3	319.405	0.498	20	10		DCCDHO
[O-]c1cc(Cl)ccc1CN1CC[NH2+]CCNCC[NH2+]CC1	ZINC001235870505	769955103	/nfs/dbraw/zinc/95/51/03/769955103.db2.gz	OATBFDLQGXRTRM-UHFFFAOYSA-N	1	3	312.845	0.630	20	10		DCCDHO
CCN1CCN(c2ccc(CN3C[C@@H]([NH3+])[C@H](O)C3)cc2)CC1	ZINC001205352864	772988189	/nfs/dbraw/zinc/98/81/89/772988189.db2.gz	QGNWWOJWCFVZEV-IAGOWNOFSA-N	1	3	304.438	0.332	20	10		DCCDHO
CN(C)c1ccc([C@@H](CNC(=O)C[C@H](O)C[NH3+])N(C)C)cc1	ZINC001342295100	953282343	/nfs/dbraw/zinc/28/23/43/953282343.db2.gz	ZOKXJELTSFWJHS-LSDHHAIUSA-N	1	3	308.426	0.181	20	10		DCCDHO
CCN(CCO)CC[NH2+]Cc1ccc(N2CCN(C)CC2)cc1	ZINC000768947126	668627926	/nfs/dbraw/zinc/62/79/26/668627926.db2.gz	ZANMVEVOPPNNRJ-UHFFFAOYSA-N	1	3	320.481	0.842	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@@H+]3C[C@H](O)[C@H](CO)C3)cc2)CC1	ZINC001140302434	768524608	/nfs/dbraw/zinc/52/46/08/768524608.db2.gz	RFDWDRXIXALLPO-WMZOPIPTSA-N	1	3	319.449	0.614	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@H+]3C[C@H](O)[C@H](CO)C3)cc2)CC1	ZINC001140302434	768524612	/nfs/dbraw/zinc/52/46/12/768524612.db2.gz	RFDWDRXIXALLPO-WMZOPIPTSA-N	1	3	319.449	0.614	20	10		DCCDHO
COCC[C@@H]([NH3+])C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001514582409	1016980389	/nfs/dbraw/zinc/98/03/89/1016980389.db2.gz	SVAKFSNJYBGDNP-CVEARBPZSA-N	1	3	322.453	0.835	20	10		DCCDHO
CN(C)CCN(C(=O)Cc1ccc(N)cc1)[C@@H]1CCC[NH2+]C1	ZINC001161449299	772225086	/nfs/dbraw/zinc/22/50/86/772225086.db2.gz	LGUCAUHBTLTLKG-MRXNPFEDSA-N	1	3	304.438	0.954	20	10		DCCDHO
COC(=O)Cc1ccc(C[N@@H+]2CCC[C@@](O)(C[NH3+])CC2)c([O-])c1	ZINC001205255863	772985567	/nfs/dbraw/zinc/98/55/67/772985567.db2.gz	MGHTZUOPORXBOP-KRWDZBQOSA-N	1	3	322.405	0.783	20	10		DCCDHO
COC(=O)Cc1ccc(C[N@H+]2CCC[C@@](O)(C[NH3+])CC2)c([O-])c1	ZINC001205255863	772985572	/nfs/dbraw/zinc/98/55/72/772985572.db2.gz	MGHTZUOPORXBOP-KRWDZBQOSA-N	1	3	322.405	0.783	20	10		DCCDHO
[NH3+][C@H](CC(=O)N1CCOC2(CC[NH2+]CC2)C1)c1ccccc1[O-]	ZINC001158077343	771722453	/nfs/dbraw/zinc/72/24/53/771722453.db2.gz	TYPBGCUKEFRAMZ-CQSZACIVSA-N	1	3	319.405	0.763	20	10		DCCDHO
N[C@@H](CCCC[NH3+])C(=O)N1CCCc2cc(O)c(O)cc2C1	ZINC001160924057	772137879	/nfs/dbraw/zinc/13/78/79/772137879.db2.gz	AQQFAYLJZWHBIT-ZDUSSCGKSA-N	1	3	307.394	0.829	20	10		DCCDHO
O=C1O[C@H]2C[NH2+]C[C@H]2N1[C@@H]1CC[N@@H+](Cc2ccccc2[O-])C1	ZINC000872255205	667882624	/nfs/dbraw/zinc/88/26/24/667882624.db2.gz	RDBMCDGBLOJURQ-NFAWXSAZSA-N	1	3	303.362	0.759	20	10		DCCDHO
O=C1O[C@H]2C[NH2+]C[C@H]2N1[C@@H]1CC[N@H+](Cc2ccccc2[O-])C1	ZINC000872255205	667882629	/nfs/dbraw/zinc/88/26/29/667882629.db2.gz	RDBMCDGBLOJURQ-NFAWXSAZSA-N	1	3	303.362	0.759	20	10		DCCDHO
C[NH+](C)CCN1CCO[C@H]2CN(Cc3ccc(O)cc3O)C[C@H]21	ZINC001275952955	952557283	/nfs/dbraw/zinc/55/72/83/952557283.db2.gz	QAKNJEHFGQJEHK-WBVHZDCISA-N	1	3	321.421	0.544	20	10		DCCDHO
CN(C)c1ccc([C@@H](CN[C@@H]2C[NH2+]CCOC2)N(C)C)cc1	ZINC000902516376	663417564	/nfs/dbraw/zinc/41/75/64/663417564.db2.gz	CWINBZMMQBIXKR-NVXWUHKLSA-N	1	3	306.454	0.933	20	10		DCCDHO
N[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCS(=O)(=O)CC2)cc1	ZINC000854221571	670536118	/nfs/dbraw/zinc/53/61/18/670536118.db2.gz	PKORXHMDNHLZLB-HOTGVXAUSA-N	1	3	323.462	0.891	20	10		DCCDHO
c1cc(N2CC[NH2+]CC2)ccc1CN1CC2(C1)CNCCO2	ZINC001222441871	775350362	/nfs/dbraw/zinc/35/03/62/775350362.db2.gz	VDNXBWFVXIFAEG-UHFFFAOYSA-N	1	3	302.422	0.270	20	10		DCCDHO
C[NH+](C)CCN1CCC2(CN(Cc3cc(O)c(O)cc3O)C2)C1	ZINC001276517002	944196647	/nfs/dbraw/zinc/19/66/47/944196647.db2.gz	YVYNOGAGLGTRHN-UHFFFAOYSA-N	1	3	321.421	0.873	20	10		DCCDHO
COC(=O)[C@H](O)C[NH2+]C1CCN(Cc2ccccc2O)CC1	ZINC001252444096	945932884	/nfs/dbraw/zinc/93/28/84/945932884.db2.gz	JNXSXKVJGWAPAT-OAHLLOKOSA-N	1	3	308.378	0.480	20	10		DCCDHO
CN(C)c1ccc([C@H](CNC(=O)[C@@H]2OCC[C@@H]2[NH3+])N(C)C)cc1	ZINC001341512712	953234533	/nfs/dbraw/zinc/23/45/33/953234533.db2.gz	LPGOGVUNDGBCLX-HRCADAONSA-N	1	3	320.437	0.588	20	10		DCCDHO
CN1CCN(c2ccc(CN[C@H]3C[NH2+]CCOC3)cc2)CC1	ZINC000925764478	660817467	/nfs/dbraw/zinc/81/74/67/660817467.db2.gz	ZNQJJAXGTBHFDX-INIZCTEOSA-N	1	3	304.438	0.516	20	10		DCCDHO
c1cc(N2CC[NH2+]CC2)ccc1CN1C[C@H]2CNC[C@@H](C1)O2	ZINC001235339257	769817656	/nfs/dbraw/zinc/81/76/56/769817656.db2.gz	SUWQQRUOMULTEC-CALCHBBNSA-N	1	3	302.422	0.269	20	10		DCCDHO
COC(=O)[C@H]1C[C@H](NCc2ccc(N3CC[NH2+]CC3)cc2)CN1	ZINC001246174980	945354425	/nfs/dbraw/zinc/35/44/25/945354425.db2.gz	QUVCKTAQFZWFDE-GOEBONIOSA-N	1	3	318.421	0.089	20	10		DCCDHO
COCCNCC(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC001341513377	953234548	/nfs/dbraw/zinc/23/45/48/953234548.db2.gz	QHMQWHIZICDNEL-MRXNPFEDSA-N	1	3	322.453	0.708	20	10		DCCDHO
COc1cc(O)c(C[NH2+]CC2(O)CCN(C)CC2)cc1OC	ZINC000271801672	395871382	/nfs/dbraw/zinc/87/13/82/395871382.db2.gz	IZZYHUJKEAXOMD-UHFFFAOYSA-N	1	3	310.394	0.956	20	10		DCCDHO
CN(C)c1ccc([C@@H](CN[C@H]2C[NH2+]CCOC2)N(C)C)cc1	ZINC000902516375	663417767	/nfs/dbraw/zinc/41/77/67/663417767.db2.gz	CWINBZMMQBIXKR-DOTOQJQBSA-N	1	3	306.454	0.933	20	10		DCCDHO
CN1CCN(c2ccc(CN3CCC[C@@]([NH3+])(CO)C3)cc2)CC1	ZINC000904401394	663512423	/nfs/dbraw/zinc/51/24/23/663512423.db2.gz	HQIAXLBFDXHMRF-SFHVURJKSA-N	1	3	318.465	0.724	20	10		DCCDHO
CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@@H](N)CC(F)F)cc1	ZINC000832272279	671712701	/nfs/dbraw/zinc/71/27/01/671712701.db2.gz	DPYBZPZWDYIXMZ-NWDGAFQWSA-N	1	3	300.353	0.851	20	10		DCCDHO
CC[NH+](CC)CCN(C(=N)N)C(=O)c1cc(O)c(O)c(OC)c1	ZINC001193132844	773014776	/nfs/dbraw/zinc/01/47/76/773014776.db2.gz	ZTXXTENSRVZHCX-UHFFFAOYSA-N	1	3	324.381	0.784	20	10		DCCDHO
c1cc(N2CC[NH2+]CC2)ccc1O[C@@H]1CC[C@@H]2NCCO[C@@H]12	ZINC001218128971	774213127	/nfs/dbraw/zinc/21/31/27/774213127.db2.gz	VSVMOGDBKIQXLH-GVDBMIGSSA-N	1	3	303.406	0.994	20	10		DCCDHO
N[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCS(=O)(=O)CC2)cc1	ZINC000854221573	670536379	/nfs/dbraw/zinc/53/63/79/670536379.db2.gz	PKORXHMDNHLZLB-JKSUJKDBSA-N	1	3	323.462	0.891	20	10		DCCDHO
[NH3+][C@H](CC(=O)NCC[C@H]1CCOC12C[NH2+]C2)c1ccccc1[O-]	ZINC001219800663	774611730	/nfs/dbraw/zinc/61/17/30/774611730.db2.gz	MKOIVTWCUVBBNF-GXTWGEPZSA-N	1	3	319.405	0.667	20	10		DCCDHO
c1cc(N2CC[NH2+]CC2)ccc1CN1CCOC2(CNC2)C1	ZINC001222446734	775352829	/nfs/dbraw/zinc/35/28/29/775352829.db2.gz	BOZLHZFDEPRFQU-UHFFFAOYSA-N	1	3	302.422	0.270	20	10		DCCDHO
C[NH2+]CCNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001337016110	952797474	/nfs/dbraw/zinc/79/74/74/952797474.db2.gz	ORSWVOXMMKLOHN-HNNXBMFYSA-N	1	3	307.442	0.874	20	10		DCCDHO
[O-]c1ccc(Cl)cc1CN1CC[NH2+]CCNCC[NH2+]CC1	ZINC001235869087	769952135	/nfs/dbraw/zinc/95/21/35/769952135.db2.gz	JTOFGGYJDOHQGU-UHFFFAOYSA-N	1	3	312.845	0.630	20	10		DCCDHO
c1cc(N2CC[NH2+]CC2)ccc1CN1CC[C@@H]2OCCN[C@H]2C1	ZINC001235206972	769779607	/nfs/dbraw/zinc/77/96/07/769779607.db2.gz	RYWVTDQCBCBWHB-ROUUACIJSA-N	1	3	316.449	0.659	20	10		DCCDHO
CN(C)c1ccc([C@H](CNC(=O)[C@@H](N)C(C)(C)O)[NH+](C)C)cc1	ZINC001343047998	953319812	/nfs/dbraw/zinc/31/98/12/953319812.db2.gz	QZLRNAOCFRWPLK-LSDHHAIUSA-N	1	3	322.453	0.570	20	10		DCCDHO
CN(C)c1ccc([C@@H](CNC(=O)COCC[NH3+])N(C)C)cc1	ZINC001343165924	953326353	/nfs/dbraw/zinc/32/63/53/953326353.db2.gz	MHOWUJUPTKCJMX-OAHLLOKOSA-N	1	3	308.426	0.447	20	10		DCCDHO
CO[C@@H](C[NH3+])C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001345636518	953694554	/nfs/dbraw/zinc/69/45/54/953694554.db2.gz	GEUMVAUBPGKQFL-GJZGRUSLSA-N	1	3	308.426	0.445	20	10		DCCDHO
COc1cc(CN2CC[C@@H](C(N)=O)C2)cc(C[NH+](C)C)c1O	ZINC001139257304	768464434	/nfs/dbraw/zinc/46/44/34/768464434.db2.gz	XJUKWDZNPRXQLA-GFCCVEGCSA-N	1	3	307.394	0.770	20	10		DCCDHO
O=C([C@H]1C[NH2+]CC12CNC2)N1CCCc2cc(O)c(O)cc2C1	ZINC001160924144	772138726	/nfs/dbraw/zinc/13/87/26/772138726.db2.gz	DNDMXEDCSQHUDY-CYBMUJFWSA-N	1	3	317.389	0.182	20	10		DCCDHO
CN(C)CCN(C(=O)Cc1ccc(N)cc1)[C@H]1CCC[NH2+]C1	ZINC001161449298	772225337	/nfs/dbraw/zinc/22/53/37/772225337.db2.gz	LGUCAUHBTLTLKG-INIZCTEOSA-N	1	3	304.438	0.954	20	10		DCCDHO
CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[NH2+]CC12CNC2	ZINC001161135509	772173101	/nfs/dbraw/zinc/17/31/01/772173101.db2.gz	XRBFQDMSYKRSHE-INIZCTEOSA-N	1	3	316.449	0.910	20	10		DCCDHO
[NH3+]C[C@H]1CN(Cc2cc3c4c(c2O)CCCN4CCC3)C[C@H]1O	ZINC001206468833	773079622	/nfs/dbraw/zinc/07/96/22/773079622.db2.gz	KZECWDIWNWPNAO-GOEBONIOSA-N	1	3	317.433	0.842	20	10		DCCDHO
CN(C)c1ccc([C@@H](CNC(=O)NCC2C[NH2+]C2)N(C)C)cc1	ZINC001336241067	952666006	/nfs/dbraw/zinc/66/60/06/952666006.db2.gz	PAFXMAGOAJXYLD-MRXNPFEDSA-N	1	3	319.453	0.874	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@H+]3C[C@H](CO)[C@H](O)C3)cc2)CC1	ZINC001140302432	768524242	/nfs/dbraw/zinc/52/42/42/768524242.db2.gz	RFDWDRXIXALLPO-SJLPKXTDSA-N	1	3	319.449	0.614	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@@H+]3C[C@H](CO)[C@H](O)C3)cc2)CC1	ZINC001140302432	768524249	/nfs/dbraw/zinc/52/42/49/768524249.db2.gz	RFDWDRXIXALLPO-SJLPKXTDSA-N	1	3	319.449	0.614	20	10		DCCDHO
COC(=O)[C@@H](O)C[NH2+]C1CCN(Cc2ccccc2O)CC1	ZINC001252444094	945931705	/nfs/dbraw/zinc/93/17/05/945931705.db2.gz	JNXSXKVJGWAPAT-HNNXBMFYSA-N	1	3	308.378	0.480	20	10		DCCDHO
COc1cc(O)c(CN(C)CCN2CC[NH2+]CC2)cc1OC	ZINC000843053282	672056593	/nfs/dbraw/zinc/05/65/93/672056593.db2.gz	SUGAWLLVYWHEEA-UHFFFAOYSA-N	1	3	309.410	0.746	20	10		DCCDHO
CCOC(=O)CN(CC[NH3+])c1cc2c(cc1[N+](=O)[O-])CNC2	ZINC001170995279	766381193	/nfs/dbraw/zinc/38/11/93/766381193.db2.gz	IBHYKNPTDTYHLR-UHFFFAOYSA-N	1	3	308.338	0.526	20	10		DCCDHO
COc1ccc(C[NH2+]CC2(O)CCN(C)CC2)c(O)c1OC	ZINC000893039524	659698791	/nfs/dbraw/zinc/69/87/91/659698791.db2.gz	XTDDSKQJRFTDEH-UHFFFAOYSA-N	1	3	310.394	0.956	20	10		DCCDHO
CN1CCN(c2ccc(CN3CCN(C)C[C@@H]3C[NH3+])cc2)CC1	ZINC000843121318	672064201	/nfs/dbraw/zinc/06/42/01/672064201.db2.gz	DBWOQFOVCVTSNM-SFHVURJKSA-N	1	3	317.481	0.513	20	10		DCCDHO
[NH3+][C@H](CC(=O)N1CCO[C@@H]2C[NH2+]C[C@@H]2C1)c1ccccc1[O-]	ZINC001158179447	771734846	/nfs/dbraw/zinc/73/48/46/771734846.db2.gz	MOZYCXRJEVWUAJ-UXIGCNINSA-N	1	3	305.378	0.229	20	10		DCCDHO
COC(=O)[C@H]1C[C@@H](NCc2ccc(N3CC[NH2+]CC3)cc2)CN1	ZINC001246174973	945354309	/nfs/dbraw/zinc/35/43/09/945354309.db2.gz	QUVCKTAQFZWFDE-GDBMZVCRSA-N	1	3	318.421	0.089	20	10		DCCDHO
C[NH2+]CCNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001337016112	952796943	/nfs/dbraw/zinc/79/69/43/952796943.db2.gz	ORSWVOXMMKLOHN-OAHLLOKOSA-N	1	3	307.442	0.874	20	10		DCCDHO
COCC[C@@H]([NH3+])C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001514582411	1016980752	/nfs/dbraw/zinc/98/07/52/1016980752.db2.gz	SVAKFSNJYBGDNP-HZPDHXFCSA-N	1	3	322.453	0.835	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@@H+]3C[C@@H](O)[C@H](CO)C3)cc2)CC1	ZINC001140302408	768524296	/nfs/dbraw/zinc/52/42/96/768524296.db2.gz	RFDWDRXIXALLPO-FUHWJXTLSA-N	1	3	319.449	0.614	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@H+]3C[C@@H](O)[C@H](CO)C3)cc2)CC1	ZINC001140302408	768524299	/nfs/dbraw/zinc/52/42/99/768524299.db2.gz	RFDWDRXIXALLPO-FUHWJXTLSA-N	1	3	319.449	0.614	20	10		DCCDHO
[NH3+][C@H](CC(=O)N1CC(O)([C@H]2CCCC[NH2+]2)C1)c1ccccc1[O-]	ZINC001161009510	772148306	/nfs/dbraw/zinc/14/83/06/772148306.db2.gz	WIAHGUGTFDDWDN-UKRRQHHQSA-N	1	3	319.405	0.498	20	10		DCCDHO
[NH3+][C@H](CC(=O)NCC[C@@H]1CCOC12C[NH2+]C2)c1ccccc1[O-]	ZINC001219800763	774612228	/nfs/dbraw/zinc/61/22/28/774612228.db2.gz	MKOIVTWCUVBBNF-TZMCWYRMSA-N	1	3	319.405	0.667	20	10		DCCDHO
[NH3+][C@H](CC(=O)NC[C@H]1C[C@@H]2C[NH2+]C[C@@H]2O1)c1ccccc1[O-]	ZINC001219831327	774623354	/nfs/dbraw/zinc/62/33/54/774623354.db2.gz	GVUYMAVPTIRHIZ-CVMIBZJCSA-N	1	3	305.378	0.275	20	10		DCCDHO
CN(C)c1ccc([C@@H](CNC(=O)CNCC[NH3+])N(C)C)cc1	ZINC001263260258	947827436	/nfs/dbraw/zinc/82/74/36/947827436.db2.gz	WFPGQWZBFRFDQF-OAHLLOKOSA-N	1	3	307.442	0.020	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@H+](C)C[C@H](O)CO)cc2)CC1	ZINC001140304203	768524135	/nfs/dbraw/zinc/52/41/35/768524135.db2.gz	ZWUSXJRVEZALHC-KRWDZBQOSA-N	1	3	307.438	0.614	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@@H+](C)C[C@H](O)CO)cc2)CC1	ZINC001140304203	768524139	/nfs/dbraw/zinc/52/41/39/768524139.db2.gz	ZWUSXJRVEZALHC-KRWDZBQOSA-N	1	3	307.438	0.614	20	10		DCCDHO
COc1cc([O-])c(CN(CC[NH3+])CC[NH3+])cc1Br	ZINC001235876716	769958662	/nfs/dbraw/zinc/95/86/62/769958662.db2.gz	AXNGZSFDNDRZOQ-UHFFFAOYSA-N	1	3	318.215	0.883	20	10		DCCDHO
COCC[C@H]([NH3+])C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001514582410	1016982056	/nfs/dbraw/zinc/98/20/56/1016982056.db2.gz	SVAKFSNJYBGDNP-HOTGVXAUSA-N	1	3	322.453	0.835	20	10		DCCDHO
CN(C)c1ccc([C@@H](CNC(=O)[C@@H](N)C(C)(C)O)[NH+](C)C)cc1	ZINC001343047997	953319633	/nfs/dbraw/zinc/31/96/33/953319633.db2.gz	QZLRNAOCFRWPLK-HUUCEWRRSA-N	1	3	322.453	0.570	20	10		DCCDHO
CN(C)c1ccc([C@H](CNC(=O)CNCC[NH3+])N(C)C)cc1	ZINC001263260257	947827788	/nfs/dbraw/zinc/82/77/88/947827788.db2.gz	WFPGQWZBFRFDQF-HNNXBMFYSA-N	1	3	307.442	0.020	20	10		DCCDHO
CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@H](N)CC(F)F)cc1	ZINC000832272281	671712901	/nfs/dbraw/zinc/71/29/01/671712901.db2.gz	DPYBZPZWDYIXMZ-VXGBXAGGSA-N	1	3	300.353	0.851	20	10		DCCDHO
COc1cccc([O-])c1C[N@@H+]1CCC[C@H](C(=O)NCC[NH3+])C1	ZINC000843048171	672056062	/nfs/dbraw/zinc/05/60/62/672056062.db2.gz	ROFLGIOUEJHJNX-LBPRGKRZSA-N	1	3	307.394	0.688	20	10		DCCDHO
COc1cccc([O-])c1C[N@H+]1CCC[C@H](C(=O)NCC[NH3+])C1	ZINC000843048171	672056063	/nfs/dbraw/zinc/05/60/63/672056063.db2.gz	ROFLGIOUEJHJNX-LBPRGKRZSA-N	1	3	307.394	0.688	20	10		DCCDHO
CN(C)c1ccc([C@H](CNC(=O)N(C)CC[NH3+])N(C)C)cc1	ZINC001262601396	947737784	/nfs/dbraw/zinc/73/77/84/947737784.db2.gz	CURNPNUZFICYMZ-HNNXBMFYSA-N	1	3	307.442	0.955	20	10		DCCDHO
CN1CCN(c2ccc(CN3CCN(C)C[C@H]3C[NH3+])cc2)CC1	ZINC000843121317	672064138	/nfs/dbraw/zinc/06/41/38/672064138.db2.gz	DBWOQFOVCVTSNM-GOSISDBHSA-N	1	3	317.481	0.513	20	10		DCCDHO
CN(CCOCC[NH3+])Cc1ccc(N2CCN(C)CC2)c(F)c1	ZINC001331846882	951359485	/nfs/dbraw/zinc/35/94/85/951359485.db2.gz	JINWQWDMXLVFSQ-UHFFFAOYSA-N	1	3	324.444	0.985	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@H+](C)C[C@@H](O)CO)cc2)CC1	ZINC001140304204	768524471	/nfs/dbraw/zinc/52/44/71/768524471.db2.gz	ZWUSXJRVEZALHC-QGZVFWFLSA-N	1	3	307.438	0.614	20	10		DCCDHO
CCN1CCN(c2ccc(C[N@@H+](C)C[C@@H](O)CO)cc2)CC1	ZINC001140304204	768524474	/nfs/dbraw/zinc/52/44/74/768524474.db2.gz	ZWUSXJRVEZALHC-QGZVFWFLSA-N	1	3	307.438	0.614	20	10		DCCDHO
CCN1CCN(c2ccc(CN3CC[C@@H](O)[C@H]([NH3+])C3)cc2)CC1	ZINC001206092808	773047054	/nfs/dbraw/zinc/04/70/54/773047054.db2.gz	ZGXPYKWEYNQGID-QZTJIDSGSA-N	1	3	318.465	0.722	20	10		DCCDHO
[NH3+][C@H](CC(=O)N[C@H]1CC[C@@H]2[NH2+]CCO[C@@H]12)c1ccccc1[O-]	ZINC001219848608	774627249	/nfs/dbraw/zinc/62/72/49/774627249.db2.gz	ZQLZCKZKMCKIJM-LMOYCYGVSA-N	1	3	305.378	0.418	20	10		DCCDHO
COC(=O)[C@H](CCC[NH3+])NC(=O)C[C@@H]([NH3+])c1ccccc1[O-]	ZINC001221190659	775022258	/nfs/dbraw/zinc/02/22/58/775022258.db2.gz	XIZCASIJLXJOKL-NEPJUHHUSA-N	1	3	309.366	0.179	20	10		DCCDHO
CN(C)c1ccc([C@@H](CNC(=O)[C@H]2[C@@H]3C[NH2+]C[C@@H]32)N(C)C)cc1	ZINC001263260227	947827774	/nfs/dbraw/zinc/82/77/74/947827774.db2.gz	VEYPQAKHODGHOM-TWMKSMIVSA-N	1	3	316.449	0.937	20	10		DCCDHO
CO[C@H](C[NH3+])CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001341624449	953241338	/nfs/dbraw/zinc/24/13/38/953241338.db2.gz	ZWAGGNPTQGYLHB-HOTGVXAUSA-N	1	3	322.453	0.835	20	10		DCCDHO
COc1ccc(N(C)CCN(C)CCN2CC[NH2+]CC2)cc1	ZINC000846225746	672302459	/nfs/dbraw/zinc/30/24/59/672302459.db2.gz	TUXUWWVYVVDMFP-UHFFFAOYSA-N	1	3	306.454	0.968	20	10		DCCDHO
O=C([C@@H]1C[NH2+]CC12CNC2)N1CCCc2cc(O)c(O)cc2C1	ZINC001160924145	772138763	/nfs/dbraw/zinc/13/87/63/772138763.db2.gz	DNDMXEDCSQHUDY-ZDUSSCGKSA-N	1	3	317.389	0.182	20	10		DCCDHO
COC(=O)Cc1ccc(C[N@@H+]2CCC[C@](O)(C[NH3+])CC2)c([O-])c1	ZINC001205255864	772985325	/nfs/dbraw/zinc/98/53/25/772985325.db2.gz	MGHTZUOPORXBOP-QGZVFWFLSA-N	1	3	322.405	0.783	20	10		DCCDHO
COC(=O)Cc1ccc(C[N@H+]2CCC[C@](O)(C[NH3+])CC2)c([O-])c1	ZINC001205255864	772985327	/nfs/dbraw/zinc/98/53/27/772985327.db2.gz	MGHTZUOPORXBOP-QGZVFWFLSA-N	1	3	322.405	0.783	20	10		DCCDHO
COC(=O)[C@H]1CNCCN1Cc1ccc(N2CC[NH2+]CC2)cc1	ZINC001222413901	775345365	/nfs/dbraw/zinc/34/53/65/775345365.db2.gz	FPFQOXTUZXZTNB-MRXNPFEDSA-N	1	3	318.421	0.043	20	10		DCCDHO
CN1CCN(c2ccc(CN[C@@H]3C[NH2+]CCOC3)cc2)CC1	ZINC000925764479	660817497	/nfs/dbraw/zinc/81/74/97/660817497.db2.gz	ZNQJJAXGTBHFDX-MRXNPFEDSA-N	1	3	304.438	0.516	20	10		DCCDHO
C[NH+](C)C[C@@H]1CN(C(=O)c2cccc(O)c2[O-])C[C@H]1C[NH+](C)C	ZINC000870019905	667699045	/nfs/dbraw/zinc/69/90/45/667699045.db2.gz	VLDPEMGJXDQPTB-CHWSQXEVSA-N	1	3	321.421	0.909	20	10		DCCDHO
CO[C@@H](C[NH3+])CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001341624450	953241082	/nfs/dbraw/zinc/24/10/82/953241082.db2.gz	ZWAGGNPTQGYLHB-HZPDHXFCSA-N	1	3	322.453	0.835	20	10		DCCDHO
CN1CCN(c2ccc(C[NH2+]C[C@@H]3CNCCO3)cc2)CC1	ZINC000841099423	671912060	/nfs/dbraw/zinc/91/20/60/671912060.db2.gz	PSFUTIUMKQZPAH-KRWDZBQOSA-N	1	3	304.438	0.516	20	10		DCCDHO
CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1C[NH2+]CC12CNC2	ZINC001161135510	772173050	/nfs/dbraw/zinc/17/30/50/772173050.db2.gz	XRBFQDMSYKRSHE-MRXNPFEDSA-N	1	3	316.449	0.910	20	10		DCCDHO
COCCNCC[NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1	ZINC001325321628	947754275	/nfs/dbraw/zinc/75/42/75/947754275.db2.gz	WRCGRIZJIKEKBY-UHFFFAOYSA-N	1	3	324.444	0.903	20	10		DCCDHO
c1cc(N2CC[NH2+]CC2)ccc1O[C@H]1CC[C@@H]2NCCO[C@H]21	ZINC001218151151	774214054	/nfs/dbraw/zinc/21/40/54/774214054.db2.gz	VSVMOGDBKIQXLH-YESZJQIVSA-N	1	3	303.406	0.994	20	10		DCCDHO
[NH3+][C@H](CC(=O)Nc1cnn(C2C[NH2+]C2)c1)c1ccccc1[O-]	ZINC001218640271	774270511	/nfs/dbraw/zinc/27/05/11/774270511.db2.gz	GYQZJDRTEOEWJW-CYBMUJFWSA-N	1	3	301.350	0.762	20	10		DCCDHO
CN(C)c1ccc([C@@H](CNC(=O)C[C@@H](O)C[NH3+])N(C)C)cc1	ZINC001342295098	953282235	/nfs/dbraw/zinc/28/22/35/953282235.db2.gz	ZOKXJELTSFWJHS-HUUCEWRRSA-N	1	3	308.426	0.181	20	10		DCCDHO
CO[C@@H](C[NH3+])C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C	ZINC001345636517	953694959	/nfs/dbraw/zinc/69/49/59/953694959.db2.gz	GEUMVAUBPGKQFL-CABCVRRESA-N	1	3	308.426	0.445	20	10		DCCDHO