smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCC[C@@H]([NH2+]CC[C@@H](C)[NH2+]C)c1cccc([N+](=O)[O-])c1	ZINC001326474274	934982319	/nfs/dbraw/zinc/98/23/19/934982319.db2.gz	UHTSJLZISANABV-IUODEOHRSA-N	2	0	279.384	3.024	20	5		CGBDRP
CC[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000181565088	189300860	/nfs/dbraw/zinc/30/08/60/189300860.db2.gz	HCCXSHKOSHCTNO-GOEBONIOSA-N	2	0	291.395	3.120	20	5		CGBDRP
C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000925596088	619079205	/nfs/dbraw/zinc/07/92/05/619079205.db2.gz	UNZBPLQFTGVUCQ-IACUBPJLSA-N	2	0	291.395	3.151	20	5		CGBDRP
C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000925674450	619124299	/nfs/dbraw/zinc/12/42/99/619124299.db2.gz	JVQAGRYMNCMPPD-FPMFFAJLSA-N	2	0	291.395	3.151	20	5		CGBDRP
CCC[C@@H]([NH2+]CCC(C)(C)[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000925741258	638593255	/nfs/dbraw/zinc/59/32/55/638593255.db2.gz	OAOVGAZAJVAGKB-CQSZACIVSA-N	2	0	279.384	3.153	20	5		CGBDRP
CCCC[NH+](CCCC)CCCO[C@H](C)C[N+](C)(C)C	ZINC001224755293	816872962	/nfs/dbraw/zinc/87/29/62/816872962.db2.gz	LYAWBEVFHIVBHO-QGZVFWFLSA-N	2	0	287.512	3.390	20	5		CGBDRP
CC[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000423275394	529655890	/nfs/dbraw/zinc/65/58/90/529655890.db2.gz	NCZJBHXYXDBNLA-CWRNSKLLSA-N	2	0	291.395	3.153	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cc1[N+](=O)[O-]	ZINC000423267325	236014419	/nfs/dbraw/zinc/01/44/19/236014419.db2.gz	FGZWVOQJRQDUEI-AEGPPILISA-N	2	0	291.395	3.071	20	5		CGBDRP
CCC[C@@H](NC[C@@H](C)C[NH+](C)C)c1cccc([N+](=O)[O-])c1	ZINC000336850230	376011149	/nfs/dbraw/zinc/01/11/49/376011149.db2.gz	WOTHTCZZAYHVPK-CZUORRHYSA-N	2	0	293.411	3.223	20	5		CGBDRP
C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000421870246	287011431	/nfs/dbraw/zinc/01/14/31/287011431.db2.gz	DWVTYAVUVAKSOM-LRVUVFPRSA-N	2	0	291.395	3.118	20	5		CGBDRP
CCC[C@@H]([NH2+]CCC[NH2+]C1CC1)c1cccc([N+](=O)[O-])c1	ZINC000423529667	529006820	/nfs/dbraw/zinc/00/68/20/529006820.db2.gz	QGGHLPXAKLATMC-MRXNPFEDSA-N	2	0	291.395	3.168	20	5		CGBDRP
C[C@@H]([NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-]	ZINC000925727662	638584452	/nfs/dbraw/zinc/58/44/52/638584452.db2.gz	BHNFBSSTNDQYOW-FRRDWIJNSA-N	2	0	291.395	3.151	20	5		CGBDRP
CCC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000423409066	393666542	/nfs/dbraw/zinc/66/65/42/393666542.db2.gz	YLZQZIGGVSCXQN-WQVCFCJDSA-N	2	0	291.395	3.024	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cc1[N+](=O)[O-]	ZINC000578867750	335682591	/nfs/dbraw/zinc/68/25/91/335682591.db2.gz	BCRRFMDHGUNUOF-ZDUSSCGKSA-N	2	0	299.374	3.213	20	5		CGBDRP
CCC[C@H]([NH2+]CC[C@H](C)[NH2+]C)c1cccc([N+](=O)[O-])c1	ZINC001326474277	934982742	/nfs/dbraw/zinc/98/27/42/934982742.db2.gz	UHTSJLZISANABV-WFASDCNBSA-N	2	0	279.384	3.024	20	5		CGBDRP
CCC[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cccc([N+](=O)[O-])c1	ZINC000051692711	137915823	/nfs/dbraw/zinc/91/58/23/137915823.db2.gz	RJVMMYQWTGKDLK-ZBCRRDGASA-N	2	0	291.395	3.296	20	5		CGBDRP
Cc1ccc([C@@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000423482389	236082869	/nfs/dbraw/zinc/08/28/69/236082869.db2.gz	PBUHGXQKSGSSAR-UKRRQHHQSA-N	2	0	291.395	3.086	20	5		CGBDRP
C[C@H](CCC[NH3+])[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000423456813	279256239	/nfs/dbraw/zinc/25/62/39/279256239.db2.gz	OHLYHHLJVCPFLV-ABAIWWIYSA-N	2	0	291.395	3.034	20	5		CGBDRP
Nc1ccc2cc3ccc(Nc4[nH]cc[nH+]4)cc3[nH+]c2c1	ZINC001176083679	809617984	/nfs/dbraw/zinc/61/79/84/809617984.db2.gz	ABLYBLREBJJMOR-UHFFFAOYSA-N	2	0	275.315	3.437	20	5		CGBDRP
CCC[C@H](NC[C@H](C)C[NH+](C)C)c1cccc([N+](=O)[O-])c1	ZINC000336850228	376010772	/nfs/dbraw/zinc/01/07/72/376010772.db2.gz	WOTHTCZZAYHVPK-BBRMVZONSA-N	2	0	293.411	3.223	20	5		CGBDRP
C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000423427103	274475038	/nfs/dbraw/zinc/47/50/38/274475038.db2.gz	IDROMQJQQNLYRM-MLGOLLRUSA-N	2	0	291.395	3.079	20	5		CGBDRP
Cn1c[nH+]cc1Nc1ccc2cc3ccc(N)cc3[nH+]c2c1	ZINC001211250034	814860755	/nfs/dbraw/zinc/86/07/55/814860755.db2.gz	FBUFYYBJKGIISR-UHFFFAOYSA-N	2	0	289.342	3.447	20	5		CGBDRP
CC[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423334629	529622369	/nfs/dbraw/zinc/62/23/69/529622369.db2.gz	QWQHCPYEEFQAEN-JKSUJKDBSA-N	2	0	291.395	3.025	20	5		CGBDRP
CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cccc([N+](=O)[O-])c1	ZINC000592470694	346992057	/nfs/dbraw/zinc/99/20/57/346992057.db2.gz	DGDMWVDXXGIVFS-QGZVFWFLSA-N	2	0	299.374	3.294	20	5		CGBDRP
Cc1ccc([C@@H](C)[NH2+]C[C@@H](N)c2ccccc2)cc1[N+](=O)[O-]	ZINC000423234323	236004765	/nfs/dbraw/zinc/00/47/65/236004765.db2.gz	FOGQDHADDXTUCJ-CZUORRHYSA-N	2	0	299.374	3.254	20	5		CGBDRP
C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000423292088	236026739	/nfs/dbraw/zinc/02/67/39/236026739.db2.gz	LGTLMNWQRJHBIQ-OLZOCXBDSA-N	2	0	299.374	3.465	20	5		CGBDRP
CCC[C@H]([NH2+]C1CCC([NH3+])CC1)c1cccc([N+](=O)[O-])c1	ZINC000051692709	369451279	/nfs/dbraw/zinc/45/12/79/369451279.db2.gz	RJVMMYQWTGKDLK-XUJLQICISA-N	2	0	291.395	3.296	20	5		CGBDRP
Cc1ccc([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])cc1[N+](=O)[O-]	ZINC000422922436	371872267	/nfs/dbraw/zinc/87/22/67/371872267.db2.gz	SSTRKNNQVSVTPO-CHWSQXEVSA-N	2	0	279.384	3.071	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cc1[N+](=O)[O-]	ZINC000423267326	372046468	/nfs/dbraw/zinc/04/64/68/372046468.db2.gz	FGZWVOQJRQDUEI-CFVMTHIKSA-N	2	0	291.395	3.071	20	5		CGBDRP
C[C@H]([NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000925596092	619079306	/nfs/dbraw/zinc/07/93/06/619079306.db2.gz	UNZBPLQFTGVUCQ-UBHSHLNASA-N	2	0	291.395	3.151	20	5		CGBDRP
C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000925674690	619124595	/nfs/dbraw/zinc/12/45/95/619124595.db2.gz	JVQAGRYMNCMPPD-IACUBPJLSA-N	2	0	291.395	3.151	20	5		CGBDRP
C[C@H]([NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000925674693	619124650	/nfs/dbraw/zinc/12/46/50/619124650.db2.gz	JVQAGRYMNCMPPD-UBHSHLNASA-N	2	0	291.395	3.151	20	5		CGBDRP
CCC[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000925876701	619304132	/nfs/dbraw/zinc/30/41/32/619304132.db2.gz	FLNDICXZYKFPEQ-IVMMDQJWSA-N	2	0	291.395	3.153	20	5		CGBDRP
C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCCCCC[NH3+]	ZINC000873231795	634294694	/nfs/dbraw/zinc/29/46/94/634294694.db2.gz	VNHGCTQQWSDLPI-CSKARUKUSA-N	2	0	291.395	3.059	20	5		CGBDRP
Cc1ccc([C@@H](C)[NH2+]CCCCCC[NH3+])cc1[N+](=O)[O-]	ZINC000843342613	635650205	/nfs/dbraw/zinc/65/02/05/635650205.db2.gz	NDNYNDUHBHIYBT-CYBMUJFWSA-N	2	0	279.384	3.073	20	5		CGBDRP
[NH3+]CCCCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000846220154	636162353	/nfs/dbraw/zinc/16/23/53/636162353.db2.gz	DUPJVDUYOWELHE-UHFFFAOYSA-N	2	0	291.395	3.078	20	5		CGBDRP
CCC[C@H]([NH2+]CCC(C)(C)[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000925741257	638593531	/nfs/dbraw/zinc/59/35/31/638593531.db2.gz	OAOVGAZAJVAGKB-AWEZNQCLSA-N	2	0	279.384	3.153	20	5		CGBDRP
CC[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423473619	529621319	/nfs/dbraw/zinc/62/13/19/529621319.db2.gz	YREQMGJNSAGKSU-BJJXKVORSA-N	2	0	291.395	3.153	20	5		CGBDRP
CC[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423474189	529614451	/nfs/dbraw/zinc/61/44/51/529614451.db2.gz	YREQMGJNSAGKSU-XPKDYRNWSA-N	2	0	291.395	3.153	20	5		CGBDRP
CC(C)c1ccc(C[NH2+]CC[C@@H]([NH3+])C(C)C)cc1[N+](=O)[O-]	ZINC000596105981	347383938	/nfs/dbraw/zinc/38/39/38/347383938.db2.gz	OLCBDRARCVVRFF-OAHLLOKOSA-N	2	0	293.411	3.181	20	5		CGBDRP
C[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000602020160	347934342	/nfs/dbraw/zinc/93/43/42/347934342.db2.gz	JLIZXBANMCLILS-OCCSQVGLSA-N	2	0	291.395	3.024	20	5		CGBDRP
Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cccc1[N+](=O)[O-]	ZINC000423483758	236083811	/nfs/dbraw/zinc/08/38/11/236083811.db2.gz	ZHLFYFYJHBNOKG-BFHYXJOUSA-N	2	0	291.395	3.071	20	5		CGBDRP
CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000422837633	288060198	/nfs/dbraw/zinc/06/01/98/288060198.db2.gz	MPQYCRGYTQIFCG-BJJXKVORSA-N	2	0	291.395	3.024	20	5		CGBDRP
C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000423292090	289796431	/nfs/dbraw/zinc/79/64/31/289796431.db2.gz	LGTLMNWQRJHBIQ-STQMWFEESA-N	2	0	299.374	3.465	20	5		CGBDRP
CCC[C@H]([NH2+]CCC[NH2+]C1CC1)c1cccc([N+](=O)[O-])c1	ZINC000423529664	528219594	/nfs/dbraw/zinc/21/95/94/528219594.db2.gz	QGGHLPXAKLATMC-INIZCTEOSA-N	2	0	291.395	3.168	20	5		CGBDRP
CCC[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423492635	528237864	/nfs/dbraw/zinc/23/78/64/528237864.db2.gz	NZAYBQNMZUPGCR-XPKDYRNWSA-N	2	0	291.395	3.153	20	5		CGBDRP
c1ccc2c(c1)cc1ccccc1c2C[NH2+][C@@H]1[C@H]2C[NH2+]C[C@H]21	ZINC000841081370	635118676	/nfs/dbraw/zinc/11/86/76/635118676.db2.gz	VZYAPDVZLQEZAG-PMOLBWCYSA-N	2	0	288.394	3.300	20	5		CGBDRP
C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000602020158	347933900	/nfs/dbraw/zinc/93/39/00/347933900.db2.gz	JLIZXBANMCLILS-GXTWGEPZSA-N	2	0	291.395	3.024	20	5		CGBDRP
C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1	ZINC000423290843	236026101	/nfs/dbraw/zinc/02/61/01/236026101.db2.gz	FRFJJBJKOPXKIR-OLZOCXBDSA-N	2	0	299.374	3.465	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+]C2CCC(C[NH3+])CC2)cc1[N+](=O)[O-]	ZINC000422923577	371873184	/nfs/dbraw/zinc/87/31/84/371873184.db2.gz	WQAITKLWAUGSKN-OPFPJEHXSA-N	2	0	291.395	3.071	20	5		CGBDRP
CC(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-]	ZINC000414926504	380492238	/nfs/dbraw/zinc/49/22/38/380492238.db2.gz	NHZNGOMVXZSNOV-ZIAGYGMSSA-N	2	0	291.395	3.078	20	5		CGBDRP
CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1	ZINC000020049142	170979042	/nfs/dbraw/zinc/97/90/42/170979042.db2.gz	SFLIWMLIFRNCIP-CQSZACIVSA-N	2	0	293.411	3.195	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])c(C)c1CNCCC[N@@H+](C)C(C)C	ZINC001177231127	809788404	/nfs/dbraw/zinc/78/84/04/809788404.db2.gz	BPULFXWQHRRIEL-UHFFFAOYSA-N	2	0	293.411	3.032	20	5		CGBDRP
CC[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1cccc([N+](=O)[O-])c1	ZINC000596654003	347499285	/nfs/dbraw/zinc/49/92/85/347499285.db2.gz	NGQGGWCDZFJYCT-HUUCEWRRSA-N	2	0	279.384	3.009	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(CC[NH3+])CC1	ZINC000579721209	378188700	/nfs/dbraw/zinc/18/87/00/378188700.db2.gz	WZVYUMJWHZNABL-CYBMUJFWSA-N	2	0	291.395	3.025	20	5		CGBDRP
C[C@@H](CCC[NH3+])[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000423456818	278228311	/nfs/dbraw/zinc/22/83/11/278228311.db2.gz	OHLYHHLJVCPFLV-NHYWBVRUSA-N	2	0	291.395	3.034	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H]([C@@H](C)[NH3+])C1	ZINC000420287335	281021444	/nfs/dbraw/zinc/02/14/44/281021444.db2.gz	HVRYNDIMDZHJGK-HZSPNIEDSA-N	2	0	291.395	3.023	20	5		CGBDRP
Cc1c([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])cccc1[N+](=O)[O-]	ZINC000423422711	533946967	/nfs/dbraw/zinc/94/69/67/533946967.db2.gz	DICLIASGWBCOBZ-WCQYABFASA-N	2	0	279.384	3.071	20	5		CGBDRP
C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-]	ZINC000925632604	619098050	/nfs/dbraw/zinc/09/80/50/619098050.db2.gz	BHNFBSSTNDQYOW-XQQFMLRXSA-N	2	0	291.395	3.151	20	5		CGBDRP
[NH3+][C@H]1[C@H]2C[N@@H+](Cc3c4ccccc4cc4ccccc43)C[C@@H]12	ZINC001235285145	819061793	/nfs/dbraw/zinc/06/17/93/819061793.db2.gz	PGYDNLREUKZDTR-ACDBMABISA-N	2	0	288.394	3.382	20	5		CGBDRP
CC[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423473620	529614166	/nfs/dbraw/zinc/61/41/66/529614166.db2.gz	YREQMGJNSAGKSU-INWMFGNUSA-N	2	0	291.395	3.153	20	5		CGBDRP
C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1	ZINC000423290845	236025982	/nfs/dbraw/zinc/02/59/82/236025982.db2.gz	FRFJJBJKOPXKIR-STQMWFEESA-N	2	0	299.374	3.465	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CC[C@H]([NH3+])C(C)C	ZINC000420285542	393449645	/nfs/dbraw/zinc/44/96/45/393449645.db2.gz	FBPVKKLLKLZDRL-BBRMVZONSA-N	2	0	293.411	3.269	20	5		CGBDRP
CCC[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423492632	393671328	/nfs/dbraw/zinc/67/13/28/393671328.db2.gz	NZAYBQNMZUPGCR-BJJXKVORSA-N	2	0	291.395	3.153	20	5		CGBDRP
C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000453431384	278343737	/nfs/dbraw/zinc/34/37/37/278343737.db2.gz	REWQWJYPNWMMNV-CYBMUJFWSA-N	2	0	291.395	3.120	20	5		CGBDRP
CC[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000873267306	634311305	/nfs/dbraw/zinc/31/13/05/634311305.db2.gz	BOIXWIKIQKUVGN-MLGOLLRUSA-N	2	0	291.395	3.024	20	5		CGBDRP
C[C@@H]([NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-]	ZINC000925727661	638584727	/nfs/dbraw/zinc/58/47/27/638584727.db2.gz	BHNFBSSTNDQYOW-AGIUHOORSA-N	2	0	291.395	3.151	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-]	ZINC000423458859	236075774	/nfs/dbraw/zinc/07/57/74/236075774.db2.gz	KOEXSLRHOKKMQH-GUTXKFCHSA-N	2	0	291.395	3.071	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000423482390	236082794	/nfs/dbraw/zinc/08/27/94/236082794.db2.gz	PBUHGXQKSGSSAR-ZFWWWQNUSA-N	2	0	291.395	3.086	20	5		CGBDRP
C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1	ZINC000453438129	394245559	/nfs/dbraw/zinc/24/55/59/394245559.db2.gz	VOTARLSNIYQNTP-CYBMUJFWSA-N	2	0	291.395	3.120	20	5		CGBDRP
Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cc1[N+](=O)[O-]	ZINC000578867749	335682536	/nfs/dbraw/zinc/68/25/36/335682536.db2.gz	BCRRFMDHGUNUOF-CYBMUJFWSA-N	2	0	299.374	3.213	20	5		CGBDRP
CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cccc([N+](=O)[O-])c1	ZINC000602021995	347934355	/nfs/dbraw/zinc/93/43/55/347934355.db2.gz	QLVWMAJKUFZVDJ-NOLJZWGESA-N	2	0	291.395	3.153	20	5		CGBDRP
CC[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000420416741	393486195	/nfs/dbraw/zinc/48/61/95/393486195.db2.gz	VUIDAXCIRXAYPZ-MRXNPFEDSA-N	2	0	291.395	3.025	20	5		CGBDRP
C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000423292087	393658722	/nfs/dbraw/zinc/65/87/22/393658722.db2.gz	LGTLMNWQRJHBIQ-CHWSQXEVSA-N	2	0	299.374	3.465	20	5		CGBDRP
CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cccc([N+](=O)[O-])c1	ZINC000592470693	346992226	/nfs/dbraw/zinc/99/22/26/346992226.db2.gz	DGDMWVDXXGIVFS-KRWDZBQOSA-N	2	0	299.374	3.294	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)cc1[N+](=O)[O-]	ZINC000602023419	347934352	/nfs/dbraw/zinc/93/43/52/347934352.db2.gz	WQAITKLWAUGSKN-YDHLFZDLSA-N	2	0	291.395	3.071	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-]	ZINC000423458862	534225940	/nfs/dbraw/zinc/22/59/40/534225940.db2.gz	KOEXSLRHOKKMQH-YDHLFZDLSA-N	2	0	291.395	3.071	20	5		CGBDRP
C[C@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-]	ZINC000925632605	619098172	/nfs/dbraw/zinc/09/81/72/619098172.db2.gz	BHNFBSSTNDQYOW-YNEHKIRRSA-N	2	0	291.395	3.151	20	5		CGBDRP
C[C@H]([NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-]	ZINC000925632602	619098257	/nfs/dbraw/zinc/09/82/57/619098257.db2.gz	BHNFBSSTNDQYOW-AVGNSLFASA-N	2	0	291.395	3.151	20	5		CGBDRP
CC[C@H]([NH2+]CCC[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1	ZINC000037010523	369049815	/nfs/dbraw/zinc/04/98/15/369049815.db2.gz	JVGDJJAVSRWYCS-INIZCTEOSA-N	2	0	291.395	3.121	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H](CC[NH3+])C1	ZINC000420312115	393461740	/nfs/dbraw/zinc/46/17/40/393461740.db2.gz	OIDABRNKUBBDAC-UONOGXRCSA-N	2	0	291.395	3.025	20	5		CGBDRP
Cc1c([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cccc1[N+](=O)[O-]	ZINC000564989163	322052677	/nfs/dbraw/zinc/05/26/77/322052677.db2.gz	SOYHGYNPFNOJIY-CYBMUJFWSA-N	2	0	299.374	3.213	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(CC[NH3+])CC1	ZINC000579721211	335873212	/nfs/dbraw/zinc/87/32/12/335873212.db2.gz	WZVYUMJWHZNABL-ZDUSSCGKSA-N	2	0	291.395	3.025	20	5		CGBDRP
CC(C)c1ccc(CN2CC[C@H]([NH3+])C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000581831890	336149233	/nfs/dbraw/zinc/14/92/33/336149233.db2.gz	AHSGZPICZIMCNL-JSGCOSHPSA-N	2	0	291.395	3.030	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H]([C@H](C)[NH3+])C1	ZINC000420287340	393449954	/nfs/dbraw/zinc/44/99/54/393449954.db2.gz	HVRYNDIMDZHJGK-MELADBBJSA-N	2	0	291.395	3.023	20	5		CGBDRP
Cc1c([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cccc1[N+](=O)[O-]	ZINC000564989165	322052587	/nfs/dbraw/zinc/05/25/87/322052587.db2.gz	SOYHGYNPFNOJIY-ZDUSSCGKSA-N	2	0	299.374	3.213	20	5		CGBDRP
CCC[C@H]([NH2+][C@H](C)CCC[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000423458142	528239554	/nfs/dbraw/zinc/23/95/54/528239554.db2.gz	PTJADKPGRISDQI-DOMZBBRYSA-N	2	0	279.384	3.153	20	5		CGBDRP
CCC[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423254235	529007739	/nfs/dbraw/zinc/00/77/39/529007739.db2.gz	XSBVAWRUQMEXIS-XJKSGUPXSA-N	2	0	291.395	3.025	20	5		CGBDRP
CC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1	ZINC000423469163	529163467	/nfs/dbraw/zinc/16/34/67/529163467.db2.gz	CKZLRSNGLZUOJW-GOEBONIOSA-N	2	0	291.395	3.168	20	5		CGBDRP
C[N@H+](CCCCCC[NH3+])Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000710706691	800038263	/nfs/dbraw/zinc/03/82/63/800038263.db2.gz	WYIWHMVJCTTZAX-UHFFFAOYSA-N	2	0	299.802	3.199	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-]	ZINC000423458860	236076007	/nfs/dbraw/zinc/07/60/07/236076007.db2.gz	KOEXSLRHOKKMQH-GZBFAFLISA-N	2	0	291.395	3.071	20	5		CGBDRP
CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000422828793	371831470	/nfs/dbraw/zinc/83/14/70/371831470.db2.gz	BGSTZUNOLKLBBU-IUODEOHRSA-N	2	0	279.384	3.153	20	5		CGBDRP
CC(C)[N@H+](C)CCCNCc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000226392026	622965961	/nfs/dbraw/zinc/96/59/61/622965961.db2.gz	OLYJKXRTSDRDFQ-UHFFFAOYSA-N	2	0	299.802	3.068	20	5		CGBDRP
Cc1c([C@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)cccc1[N+](=O)[O-]	ZINC000423489959	236085670	/nfs/dbraw/zinc/08/56/70/236085670.db2.gz	XCYATVGGHSUXKS-UONOGXRCSA-N	2	0	291.395	3.086	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@@H](CC[NH3+])C1	ZINC000420312113	393461040	/nfs/dbraw/zinc/46/10/40/393461040.db2.gz	OIDABRNKUBBDAC-KGLIPLIRSA-N	2	0	291.395	3.025	20	5		CGBDRP
Cc1c([C@@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)cccc1[N+](=O)[O-]	ZINC000423489958	533944718	/nfs/dbraw/zinc/94/47/18/533944718.db2.gz	XCYATVGGHSUXKS-KGLIPLIRSA-N	2	0	291.395	3.086	20	5		CGBDRP
CCC[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423254234	529009136	/nfs/dbraw/zinc/00/91/36/529009136.db2.gz	XSBVAWRUQMEXIS-CZUORRHYSA-N	2	0	291.395	3.025	20	5		CGBDRP
CC(C)[PH+](CC[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C(C)C	ZINC001169001255	807549278	/nfs/dbraw/zinc/54/92/78/807549278.db2.gz	DZGRXKOTLHOPPC-ZIAGYGMSSA-N	2	0	288.372	3.320	20	5		CGBDRP
CC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1	ZINC000423469165	529600186	/nfs/dbraw/zinc/60/01/86/529600186.db2.gz	CKZLRSNGLZUOJW-HOCLYGCPSA-N	2	0	291.395	3.168	20	5		CGBDRP
CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1	ZINC000020049139	368795390	/nfs/dbraw/zinc/79/53/90/368795390.db2.gz	NSBMLKSGDDMORZ-AWEZNQCLSA-N	2	0	293.411	3.195	20	5		CGBDRP
CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000422837635	371834934	/nfs/dbraw/zinc/83/49/34/371834934.db2.gz	MPQYCRGYTQIFCG-NOLJZWGESA-N	2	0	291.395	3.024	20	5		CGBDRP
CC[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000420398882	393483240	/nfs/dbraw/zinc/48/32/40/393483240.db2.gz	HDYGRWACIIMCAF-XJKSGUPXSA-N	2	0	291.395	3.025	20	5		CGBDRP
CC(C)c1ccc(CN2CC[C@H]([NH3+])C[C@H]2C)cc1[N+](=O)[O-]	ZINC000581831891	336149253	/nfs/dbraw/zinc/14/92/53/336149253.db2.gz	AHSGZPICZIMCNL-OCCSQVGLSA-N	2	0	291.395	3.030	20	5		CGBDRP
CC(C)[PH+](CC[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)C(C)C	ZINC001169001252	807549509	/nfs/dbraw/zinc/54/95/09/807549509.db2.gz	DZGRXKOTLHOPPC-KBPBESRZSA-N	2	0	288.372	3.320	20	5		CGBDRP
CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000422837636	371834478	/nfs/dbraw/zinc/83/44/78/371834478.db2.gz	MPQYCRGYTQIFCG-XPKDYRNWSA-N	2	0	291.395	3.024	20	5		CGBDRP
C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc([N+](=O)[O-])cc1	ZINC000423352276	533450443	/nfs/dbraw/zinc/45/04/43/533450443.db2.gz	AFQYEQSGISCROI-GFCCVEGCSA-N	2	0	297.358	3.049	20	5		CGBDRP
CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000037562468	173272806	/nfs/dbraw/zinc/27/28/06/173272806.db2.gz	DALCRXBBJCPWMT-GFCCVEGCSA-N	2	0	299.440	3.256	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC([C@H](C)[NH3+])CC1	ZINC000420304511	301865876	/nfs/dbraw/zinc/86/58/76/301865876.db2.gz	XZTNEDUSURPQHX-QWHCGFSZSA-N	2	0	291.395	3.023	20	5		CGBDRP
C[C@@H](NCC[C@H]1CCCC[N@@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000932181370	639289587	/nfs/dbraw/zinc/28/95/87/639289587.db2.gz	PSCSOWQCUYQCFK-UKRRQHHQSA-N	2	0	291.395	3.120	20	5		CGBDRP
CC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000423324752	529590997	/nfs/dbraw/zinc/59/09/97/529590997.db2.gz	IXXJSJALQKWXBH-HNNXBMFYSA-N	2	0	291.395	3.025	20	5		CGBDRP
CCC[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423220307	372040115	/nfs/dbraw/zinc/04/01/15/372040115.db2.gz	XZBVGMMVVLPLOX-XJKSGUPXSA-N	2	0	291.395	3.025	20	5		CGBDRP
CCC[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423254233	528220593	/nfs/dbraw/zinc/22/05/93/528220593.db2.gz	XSBVAWRUQMEXIS-CJNGLKHVSA-N	2	0	291.395	3.025	20	5		CGBDRP
CC[C@H]([NH2+]CCCCCC[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000843342311	635650311	/nfs/dbraw/zinc/65/03/11/635650311.db2.gz	JUXPDBSFARDLBR-HNNXBMFYSA-N	2	0	279.384	3.155	20	5		CGBDRP
[NH3+]CCCCCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000846220303	636162975	/nfs/dbraw/zinc/16/29/75/636162975.db2.gz	FFVXQBXCKWVNNU-UHFFFAOYSA-N	2	0	291.395	3.078	20	5		CGBDRP
Cc1ccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1[N+](=O)[O-]	ZINC000414802476	380414849	/nfs/dbraw/zinc/41/48/49/380414849.db2.gz	BQXCOPNXLZSDQW-CYBMUJFWSA-N	2	0	299.374	3.213	20	5		CGBDRP
[NH3+]CCC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000925597347	638539591	/nfs/dbraw/zinc/53/95/91/638539591.db2.gz	YMDVTNQKMGWZCE-MRXNPFEDSA-N	2	0	299.374	3.165	20	5		CGBDRP
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCCCCC[NH3+]	ZINC000710684281	800038240	/nfs/dbraw/zinc/03/82/40/800038240.db2.gz	ZKGXZXSDWQFRAI-ZDUSSCGKSA-N	2	0	279.384	3.107	20	5		CGBDRP
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCCCCC[NH3+]	ZINC000710684280	800038727	/nfs/dbraw/zinc/03/87/27/800038727.db2.gz	ZKGXZXSDWQFRAI-CYBMUJFWSA-N	2	0	279.384	3.107	20	5		CGBDRP
CCC[C@H]([NH2+]CCC1(C[NH3+])CC1)c1cccc([N+](=O)[O-])c1	ZINC000593320103	347062186	/nfs/dbraw/zinc/06/21/86/347062186.db2.gz	RXHMHHUUMOXMEF-HNNXBMFYSA-N	2	0	291.395	3.155	20	5		CGBDRP
Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cccc1[N+](=O)[O-]	ZINC000423483761	236083395	/nfs/dbraw/zinc/08/33/95/236083395.db2.gz	ZHLFYFYJHBNOKG-MJBXVCDLSA-N	2	0	291.395	3.071	20	5		CGBDRP
CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000422828794	371831306	/nfs/dbraw/zinc/83/13/06/371831306.db2.gz	BGSTZUNOLKLBBU-SWLSCSKDSA-N	2	0	279.384	3.153	20	5		CGBDRP
C[C@@H](CCC[NH3+])[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000423456826	278227976	/nfs/dbraw/zinc/22/79/76/278227976.db2.gz	OHLYHHLJVCPFLV-XHDPSFHLSA-N	2	0	291.395	3.034	20	5		CGBDRP
CCC[C@H]([NH2+]CCC[NH2+]CC)c1cccc([N+](=O)[O-])c1	ZINC000563700593	322007197	/nfs/dbraw/zinc/00/71/97/322007197.db2.gz	JJOGXYMLZQQBMR-HNNXBMFYSA-N	2	0	279.384	3.025	20	5		CGBDRP
CC(C)c1ccc(CN2CC[C@@H]([NH3+])C[C@H]2C)cc1[N+](=O)[O-]	ZINC000581831892	336149177	/nfs/dbraw/zinc/14/91/77/336149177.db2.gz	AHSGZPICZIMCNL-TZMCWYRMSA-N	2	0	291.395	3.030	20	5		CGBDRP
C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCCCCC[NH3+]	ZINC000873231796	634294589	/nfs/dbraw/zinc/29/45/89/634294589.db2.gz	VNHGCTQQWSDLPI-NTMALXAHSA-N	2	0	291.395	3.059	20	5		CGBDRP
CC[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cccc([N+](=O)[O-])c1	ZINC000602021996	347933786	/nfs/dbraw/zinc/93/37/86/347933786.db2.gz	QLVWMAJKUFZVDJ-XNRPHZJLSA-N	2	0	291.395	3.153	20	5		CGBDRP
[NH3+]CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000415047664	393110568	/nfs/dbraw/zinc/11/05/68/393110568.db2.gz	FJZUNDCOCGPKAB-KRWDZBQOSA-N	2	0	299.374	3.165	20	5		CGBDRP
C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000925596094	619079554	/nfs/dbraw/zinc/07/95/54/619079554.db2.gz	UNZBPLQFTGVUCQ-YUTCNCBUSA-N	2	0	291.395	3.151	20	5		CGBDRP
Cc1c([C@H](C)[NH2+]CCCCCC[NH3+])cccc1[N+](=O)[O-]	ZINC000843342967	635651400	/nfs/dbraw/zinc/65/14/00/635651400.db2.gz	VWYKFSAYPGOSGK-ZDUSSCGKSA-N	2	0	279.384	3.073	20	5		CGBDRP
C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccccc1[N+](=O)[O-]	ZINC001579414844	962626800	/nfs/dbraw/zinc/62/68/00/962626800.db2.gz	RZXZVZKRHHVEJH-MGPQQGTHSA-N	2	0	291.395	3.011	20	5		CGBDRP
C[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000602019767	347933819	/nfs/dbraw/zinc/93/38/19/347933819.db2.gz	HUDWZXTUWOJWAF-JSGCOSHPSA-N	2	0	291.395	3.024	20	5		CGBDRP
CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1	ZINC000020049145	368795484	/nfs/dbraw/zinc/79/54/84/368795484.db2.gz	SFLIWMLIFRNCIP-AWEZNQCLSA-N	2	0	293.411	3.195	20	5		CGBDRP
Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])cc1[N+](=O)[O-]	ZINC000422922438	371871462	/nfs/dbraw/zinc/87/14/62/371871462.db2.gz	SSTRKNNQVSVTPO-QWHCGFSZSA-N	2	0	279.384	3.071	20	5		CGBDRP
CCC[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423220306	372039619	/nfs/dbraw/zinc/03/96/19/372039619.db2.gz	XZBVGMMVVLPLOX-CZUORRHYSA-N	2	0	291.395	3.025	20	5		CGBDRP
C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000353385040	220055547	/nfs/dbraw/zinc/05/55/47/220055547.db2.gz	IYLRFGPIXNFORU-GRTSSRMGSA-N	2	0	291.395	3.118	20	5		CGBDRP
CC[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423334626	529177594	/nfs/dbraw/zinc/17/75/94/529177594.db2.gz	QWQHCPYEEFQAEN-CVEARBPZSA-N	2	0	291.395	3.025	20	5		CGBDRP
CCC[C@H]([NH2+]CC[C@@H](C)[NH2+]C)c1cccc([N+](=O)[O-])c1	ZINC001326474272	934982052	/nfs/dbraw/zinc/98/20/52/934982052.db2.gz	UHTSJLZISANABV-DOMZBBRYSA-N	2	0	279.384	3.024	20	5		CGBDRP
CCC[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000591578222	346930224	/nfs/dbraw/zinc/93/02/24/346930224.db2.gz	BMKKNVAKNGLJJB-GOEBONIOSA-N	2	0	291.395	3.168	20	5		CGBDRP
CCC[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000423409064	283937025	/nfs/dbraw/zinc/93/70/25/283937025.db2.gz	YLZQZIGGVSCXQN-MAZHCROVSA-N	2	0	291.395	3.024	20	5		CGBDRP
CC[C@@H]([NH2+]CCC[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1	ZINC000037010524	369050096	/nfs/dbraw/zinc/05/00/96/369050096.db2.gz	JVGDJJAVSRWYCS-MRXNPFEDSA-N	2	0	291.395	3.121	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+][C@H](C)CCCC[NH3+])cc1[N+](=O)[O-]	ZINC000422922437	371871708	/nfs/dbraw/zinc/87/17/08/371871708.db2.gz	SSTRKNNQVSVTPO-OLZOCXBDSA-N	2	0	279.384	3.071	20	5		CGBDRP
C[C@H](CCCC[NH3+])[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000415012129	393094742	/nfs/dbraw/zinc/09/47/42/393094742.db2.gz	IQXXQTVCTGVBHX-KGLIPLIRSA-N	2	0	293.411	3.023	20	5		CGBDRP
CC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1	ZINC000423469162	529163383	/nfs/dbraw/zinc/16/33/83/529163383.db2.gz	CKZLRSNGLZUOJW-GDBMZVCRSA-N	2	0	291.395	3.168	20	5		CGBDRP
C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000925596087	619079574	/nfs/dbraw/zinc/07/95/74/619079574.db2.gz	UNZBPLQFTGVUCQ-FPMFFAJLSA-N	2	0	291.395	3.151	20	5		CGBDRP
Cc1ccc([C@@H](C)[NH2+]CCCCCCC[NH3+])cc1[N+](=O)[O-]	ZINC000842478156	635379954	/nfs/dbraw/zinc/37/99/54/635379954.db2.gz	GCEVEQLKTCOOGM-CQSZACIVSA-N	2	0	293.411	3.463	20	5		CGBDRP
C[C@@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-]	ZINC000925727663	638583373	/nfs/dbraw/zinc/58/33/73/638583373.db2.gz	BHNFBSSTNDQYOW-JHJVBQTASA-N	2	0	291.395	3.151	20	5		CGBDRP
Nc1ccc2cc3ccc(NC4=CCC[NH2+]C4)cc3[nH+]c2c1	ZINC001159700380	806153671	/nfs/dbraw/zinc/15/36/71/806153671.db2.gz	JHONWVCSSTYCSD-UHFFFAOYSA-N	2	0	290.370	3.259	20	5		CGBDRP
C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cccc([N+](=O)[O-])c1	ZINC000423424205	533435354	/nfs/dbraw/zinc/43/53/54/533435354.db2.gz	MSCKPVSYOMNOPX-MGPQQGTHSA-N	2	0	291.395	3.011	20	5		CGBDRP
[NH3+]CCCC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000423341832	534607534	/nfs/dbraw/zinc/60/75/34/534607534.db2.gz	YCDKOTGABZWRRW-QGZVFWFLSA-N	2	0	299.374	3.013	20	5		CGBDRP
C[C@@H]([NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000925825775	638622282	/nfs/dbraw/zinc/62/22/82/638622282.db2.gz	JVQAGRYMNCMPPD-BNOWGMLFSA-N	2	0	291.395	3.151	20	5		CGBDRP
CC[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423473621	529621252	/nfs/dbraw/zinc/62/12/52/529621252.db2.gz	YREQMGJNSAGKSU-NOLJZWGESA-N	2	0	291.395	3.153	20	5		CGBDRP
CCC[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1cccc([N+](=O)[O-])c1	ZINC000593320105	347062414	/nfs/dbraw/zinc/06/24/14/347062414.db2.gz	RXHMHHUUMOXMEF-OAHLLOKOSA-N	2	0	291.395	3.155	20	5		CGBDRP
Cc1ccc([C@@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000423482387	236082615	/nfs/dbraw/zinc/08/26/15/236082615.db2.gz	PBUHGXQKSGSSAR-HIFRSBDPSA-N	2	0	291.395	3.086	20	5		CGBDRP
C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000415012128	393095432	/nfs/dbraw/zinc/09/54/32/393095432.db2.gz	IQXXQTVCTGVBHX-KBPBESRZSA-N	2	0	293.411	3.023	20	5		CGBDRP
CCC[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000423409065	528242155	/nfs/dbraw/zinc/24/21/55/528242155.db2.gz	YLZQZIGGVSCXQN-RCBQFDQVSA-N	2	0	291.395	3.024	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])cc1[N+](=O)[O-]	ZINC000422922439	235943233	/nfs/dbraw/zinc/94/32/33/235943233.db2.gz	SSTRKNNQVSVTPO-STQMWFEESA-N	2	0	279.384	3.071	20	5		CGBDRP
Cc1c([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])cccc1[N+](=O)[O-]	ZINC000423422710	236068165	/nfs/dbraw/zinc/06/81/65/236068165.db2.gz	DICLIASGWBCOBZ-DGCLKSJQSA-N	2	0	279.384	3.071	20	5		CGBDRP
CC[C@@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000181565117	189300871	/nfs/dbraw/zinc/30/08/71/189300871.db2.gz	HCCXSHKOSHCTNO-GDBMZVCRSA-N	2	0	291.395	3.120	20	5		CGBDRP
CC(C)[N@H+](CCCCCC[NH3+])Cc1ccc([N+](=O)[O-])cc1	ZINC000846218808	636162521	/nfs/dbraw/zinc/16/25/21/636162521.db2.gz	WNGFWPCEZHYZPT-UHFFFAOYSA-N	2	0	293.411	3.324	20	5		CGBDRP
C[N@H+](CCCCCC[NH3+])Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000710705063	800037933	/nfs/dbraw/zinc/03/79/33/800037933.db2.gz	HNBZXPIJCQWFMF-UHFFFAOYSA-N	2	0	299.802	3.199	20	5		CGBDRP
C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000602019766	347934270	/nfs/dbraw/zinc/93/42/70/347934270.db2.gz	HUDWZXTUWOJWAF-GXTWGEPZSA-N	2	0	291.395	3.024	20	5		CGBDRP
C[C@H]([NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000925674695	619124496	/nfs/dbraw/zinc/12/44/96/619124496.db2.gz	JVQAGRYMNCMPPD-YUTCNCBUSA-N	2	0	291.395	3.151	20	5		CGBDRP
C[N@H+](CCCCCC[NH3+])Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000873231350	634292865	/nfs/dbraw/zinc/29/28/65/634292865.db2.gz	GVSJJFPTIQQFRK-UHFFFAOYSA-N	2	0	299.802	3.199	20	5		CGBDRP
CC[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000423275393	529669681	/nfs/dbraw/zinc/66/96/81/529669681.db2.gz	NCZJBHXYXDBNLA-BPUTZDHNSA-N	2	0	291.395	3.153	20	5		CGBDRP
CC[C@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000181565102	189300903	/nfs/dbraw/zinc/30/09/03/189300903.db2.gz	HCCXSHKOSHCTNO-ZBFHGGJFSA-N	2	0	291.395	3.120	20	5		CGBDRP
CC(C)c1ccc(C[NH2+][C@H](C)CCCC[NH3+])cc1[N+](=O)[O-]	ZINC000415019404	393100255	/nfs/dbraw/zinc/10/02/55/393100255.db2.gz	VSDUYIOAKLYKFW-CYBMUJFWSA-N	2	0	293.411	3.325	20	5		CGBDRP
CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000037562469	369089170	/nfs/dbraw/zinc/08/91/70/369089170.db2.gz	DALCRXBBJCPWMT-LBPRGKRZSA-N	2	0	299.440	3.256	20	5		CGBDRP
CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000422828795	371831612	/nfs/dbraw/zinc/83/16/12/371831612.db2.gz	BGSTZUNOLKLBBU-WFASDCNBSA-N	2	0	279.384	3.153	20	5		CGBDRP
C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000453431385	374475373	/nfs/dbraw/zinc/47/53/73/374475373.db2.gz	REWQWJYPNWMMNV-ZDUSSCGKSA-N	2	0	291.395	3.120	20	5		CGBDRP
CC(C)c1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-]	ZINC000414926498	249124367	/nfs/dbraw/zinc/12/43/67/249124367.db2.gz	NHZNGOMVXZSNOV-KBPBESRZSA-N	2	0	291.395	3.078	20	5		CGBDRP
C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cccc([N+](=O)[O-])c1	ZINC000423357041	533924250	/nfs/dbraw/zinc/92/42/50/533924250.db2.gz	KYKHSEHOELQVMI-LBPRGKRZSA-N	2	0	297.358	3.049	20	5		CGBDRP
CC[C@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000873267307	634311068	/nfs/dbraw/zinc/31/10/68/634311068.db2.gz	BOIXWIKIQKUVGN-WBMJQRKESA-N	2	0	291.395	3.024	20	5		CGBDRP
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCCCCC[NH3+]	ZINC000710684295	800039080	/nfs/dbraw/zinc/03/90/80/800039080.db2.gz	ZVGGQWRSZKEDIF-CYBMUJFWSA-N	2	0	279.384	3.107	20	5		CGBDRP
C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc([N+](=O)[O-])cc1	ZINC000423429289	372061431	/nfs/dbraw/zinc/06/14/31/372061431.db2.gz	SHTFSBSXEPJWQH-IHRRRGAJSA-N	2	0	291.395	3.011	20	5		CGBDRP
Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1	ZINC000414809039	380420194	/nfs/dbraw/zinc/42/01/94/380420194.db2.gz	LRVCOIZWAPYUPX-CYBMUJFWSA-N	2	0	299.374	3.213	20	5		CGBDRP
CCC[C@H]([NH2+][C@H]1CCC[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423373618	528240489	/nfs/dbraw/zinc/24/04/89/528240489.db2.gz	HTKDPKCGVLKFAI-YCPHGPKFSA-N	2	0	291.395	3.296	20	5		CGBDRP
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCCCCC[NH3+]	ZINC000710684296	800038963	/nfs/dbraw/zinc/03/89/63/800038963.db2.gz	ZVGGQWRSZKEDIF-ZDUSSCGKSA-N	2	0	279.384	3.107	20	5		CGBDRP
C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1	ZINC000423290842	236025425	/nfs/dbraw/zinc/02/54/25/236025425.db2.gz	FRFJJBJKOPXKIR-CHWSQXEVSA-N	2	0	299.374	3.465	20	5		CGBDRP
Cc1c([C@H](C)[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cccc1[N+](=O)[O-]	ZINC000423483760	236083978	/nfs/dbraw/zinc/08/39/78/236083978.db2.gz	ZHLFYFYJHBNOKG-MELADBBJSA-N	2	0	291.395	3.071	20	5		CGBDRP
C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000353385041	220057178	/nfs/dbraw/zinc/05/71/78/220057178.db2.gz	IYLRFGPIXNFORU-LRVUVFPRSA-N	2	0	291.395	3.118	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H](CC[NH3+])C1	ZINC000420312109	292295836	/nfs/dbraw/zinc/29/58/36/292295836.db2.gz	OIDABRNKUBBDAC-KBPBESRZSA-N	2	0	291.395	3.025	20	5		CGBDRP
C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000423426838	274208373	/nfs/dbraw/zinc/20/83/73/274208373.db2.gz	IDROMQJQQNLYRM-LRDDRELGSA-N	2	0	291.395	3.079	20	5		CGBDRP
CCC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423492634	528241581	/nfs/dbraw/zinc/24/15/81/528241581.db2.gz	NZAYBQNMZUPGCR-NOLJZWGESA-N	2	0	291.395	3.153	20	5		CGBDRP
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCCCCC[NH3+]	ZINC001254544841	806446056	/nfs/dbraw/zinc/44/60/56/806446056.db2.gz	XYTBQMOSKFZANF-CQSZACIVSA-N	2	0	293.411	3.025	20	5		CGBDRP
Cc1c([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])cccc1[N+](=O)[O-]	ZINC000423422709	236068166	/nfs/dbraw/zinc/06/81/66/236068166.db2.gz	DICLIASGWBCOBZ-AAEUAGOBSA-N	2	0	279.384	3.071	20	5		CGBDRP
CCC[C@H](NC[C@@H](C)C[NH+](C)C)c1cccc([N+](=O)[O-])c1	ZINC000336850229	376011407	/nfs/dbraw/zinc/01/14/07/376011407.db2.gz	WOTHTCZZAYHVPK-CJNGLKHVSA-N	2	0	293.411	3.223	20	5		CGBDRP
CC[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000420398879	393483269	/nfs/dbraw/zinc/48/32/69/393483269.db2.gz	HDYGRWACIIMCAF-CJNGLKHVSA-N	2	0	291.395	3.025	20	5		CGBDRP
C[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000602020161	347934189	/nfs/dbraw/zinc/93/41/89/347934189.db2.gz	JLIZXBANMCLILS-TZMCWYRMSA-N	2	0	291.395	3.024	20	5		CGBDRP
Cc1c([C@H](C)[NH2+]C[C@H](N)c2ccccc2)cccc1[N+](=O)[O-]	ZINC000423243010	236007598	/nfs/dbraw/zinc/00/75/98/236007598.db2.gz	MNJOONDSKAGNPO-BBRMVZONSA-N	2	0	299.374	3.254	20	5		CGBDRP
CCC[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423220304	372039579	/nfs/dbraw/zinc/03/95/79/372039579.db2.gz	XZBVGMMVVLPLOX-BBRMVZONSA-N	2	0	291.395	3.025	20	5		CGBDRP
CCC[C@@H]([NH2+]CCC[NH2+]CC)c1cccc([N+](=O)[O-])c1	ZINC000563700618	322007254	/nfs/dbraw/zinc/00/72/54/322007254.db2.gz	JJOGXYMLZQQBMR-OAHLLOKOSA-N	2	0	279.384	3.025	20	5		CGBDRP
C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000593321323	347063222	/nfs/dbraw/zinc/06/32/22/347063222.db2.gz	IBWJWNCTGMOBGL-ZDUSSCGKSA-N	2	0	299.374	3.165	20	5		CGBDRP
Cc1c([C@@H](C)[NH2+]C[C@H](N)c2ccccc2)cccc1[N+](=O)[O-]	ZINC000423243012	236007650	/nfs/dbraw/zinc/00/76/50/236007650.db2.gz	MNJOONDSKAGNPO-CJNGLKHVSA-N	2	0	299.374	3.254	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CC[C@@H]([NH3+])C(C)C	ZINC000420285548	393450219	/nfs/dbraw/zinc/45/02/19/393450219.db2.gz	FBPVKKLLKLZDRL-CZUORRHYSA-N	2	0	293.411	3.269	20	5		CGBDRP
CCC[C@H]([NH2+][C@H]1CCC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423373615	528239961	/nfs/dbraw/zinc/23/99/61/528239961.db2.gz	HTKDPKCGVLKFAI-DZKIICNBSA-N	2	0	291.395	3.296	20	5		CGBDRP
C[N@H+](CCCCCC[NH3+])Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000710704965	800038988	/nfs/dbraw/zinc/03/89/88/800038988.db2.gz	FUMUEHBBVYKXIQ-UHFFFAOYSA-N	2	0	299.802	3.199	20	5		CGBDRP
C[C@H](C[N+](C)(C)C)Oc1cccc(C[NH+]2CCCCC2)c1	ZINC001229448535	932153339	/nfs/dbraw/zinc/15/33/39/932153339.db2.gz	LHANPUUWLLWBHR-MRXNPFEDSA-N	2	0	291.459	3.146	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@H]2C[NH3+])cc1[N+](=O)[O-]	ZINC000423267328	292248316	/nfs/dbraw/zinc/24/83/16/292248316.db2.gz	FGZWVOQJRQDUEI-QEJZJMRPSA-N	2	0	291.395	3.071	20	5		CGBDRP
CC(C)c1ccc(CN2CC[C@@H]([NH3+])C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000581831889	336149139	/nfs/dbraw/zinc/14/91/39/336149139.db2.gz	AHSGZPICZIMCNL-GXTWGEPZSA-N	2	0	291.395	3.030	20	5		CGBDRP
CC[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000873268989	634312568	/nfs/dbraw/zinc/31/25/68/634312568.db2.gz	BOIXWIKIQKUVGN-LRDDRELGSA-N	2	0	291.395	3.024	20	5		CGBDRP
CC[N+](C)(C)Cc1ccccc1NCCCC[NH+](C)C	ZINC001161730698	806438908	/nfs/dbraw/zinc/43/89/08/806438908.db2.gz	AOTVRKMAYFYFEQ-UHFFFAOYSA-N	2	0	278.464	3.037	20	5		CGBDRP
C[C@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000602020159	347934339	/nfs/dbraw/zinc/93/43/39/347934339.db2.gz	JLIZXBANMCLILS-JSGCOSHPSA-N	2	0	291.395	3.024	20	5		CGBDRP
Cc1c([C@H](C)[NH2+][C@H]2CCCC[C@H]2C[NH3+])cccc1[N+](=O)[O-]	ZINC000423265899	236014555	/nfs/dbraw/zinc/01/45/55/236014555.db2.gz	BIHSPKGWVSJABX-YDHLFZDLSA-N	2	0	291.395	3.071	20	5		CGBDRP
C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc([N+](=O)[O-])cc1	ZINC000423352277	533925655	/nfs/dbraw/zinc/92/56/55/533925655.db2.gz	AFQYEQSGISCROI-LBPRGKRZSA-N	2	0	297.358	3.049	20	5		CGBDRP
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCCCCC[NH3+]	ZINC001173218489	808539561	/nfs/dbraw/zinc/53/95/61/808539561.db2.gz	KDASQCZJQHZRGN-AWEZNQCLSA-N	2	0	293.411	3.025	20	5		CGBDRP
CC[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000423275395	529669872	/nfs/dbraw/zinc/66/98/72/529669872.db2.gz	NCZJBHXYXDBNLA-KBMXLJTQSA-N	2	0	291.395	3.153	20	5		CGBDRP
Cc1ccc([C@@H](C)[NH2+]C[C@H](N)c2ccccc2)cc1[N+](=O)[O-]	ZINC000423234322	236004475	/nfs/dbraw/zinc/00/44/75/236004475.db2.gz	FOGQDHADDXTUCJ-CJNGLKHVSA-N	2	0	299.374	3.254	20	5		CGBDRP
C[C@@H]([NH2+][C@@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000925825777	619273725	/nfs/dbraw/zinc/27/37/25/619273725.db2.gz	JVQAGRYMNCMPPD-MRVWCRGKSA-N	2	0	291.395	3.151	20	5		CGBDRP
CCC[C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1cccc([N+](=O)[O-])c1	ZINC000596653514	347498504	/nfs/dbraw/zinc/49/85/04/347498504.db2.gz	LIWKMKDILRUOCZ-HZPDHXFCSA-N	2	0	293.411	3.399	20	5		CGBDRP
Cc1c([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)cccc1[N+](=O)[O-]	ZINC000602022009	347934350	/nfs/dbraw/zinc/93/43/50/347934350.db2.gz	RMUUTBRXBCYFEY-IHRRRGAJSA-N	2	0	291.395	3.071	20	5		CGBDRP
Cc1c([C@H](C)[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cccc1[N+](=O)[O-]	ZINC000423265898	236014250	/nfs/dbraw/zinc/01/42/50/236014250.db2.gz	BIHSPKGWVSJABX-KCQAQPDRSA-N	2	0	291.395	3.071	20	5		CGBDRP
Cc1c([C@H](C)[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cccc1[N+](=O)[O-]	ZINC000423483759	236083545	/nfs/dbraw/zinc/08/35/45/236083545.db2.gz	ZHLFYFYJHBNOKG-IHRRRGAJSA-N	2	0	291.395	3.071	20	5		CGBDRP
CC[C@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000181565066	189301151	/nfs/dbraw/zinc/30/11/51/189301151.db2.gz	HCCXSHKOSHCTNO-HOCLYGCPSA-N	2	0	291.395	3.120	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC([C@H](C)[NH3+])CC1	ZINC000420304512	380846042	/nfs/dbraw/zinc/84/60/42/380846042.db2.gz	XZTNEDUSURPQHX-STQMWFEESA-N	2	0	291.395	3.023	20	5		CGBDRP
C[C@@H]([NH2+][C@H]1CC[NH2+]CC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000602020086	347933875	/nfs/dbraw/zinc/93/38/75/347933875.db2.gz	HUDWZXTUWOJWAF-OCCSQVGLSA-N	2	0	291.395	3.024	20	5		CGBDRP
Cc1c([C@H](C)[NH2+]C[C@@H](N)c2ccccc2)cccc1[N+](=O)[O-]	ZINC000423243016	236007627	/nfs/dbraw/zinc/00/76/27/236007627.db2.gz	MNJOONDSKAGNPO-XJKSGUPXSA-N	2	0	299.374	3.254	20	5		CGBDRP
[NH3+]CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000415047665	393110944	/nfs/dbraw/zinc/11/09/44/393110944.db2.gz	FJZUNDCOCGPKAB-QGZVFWFLSA-N	2	0	299.374	3.165	20	5		CGBDRP
Cc1c([C@@H](C)[NH2+]CCCCCC[NH3+])cccc1[N+](=O)[O-]	ZINC000843342966	635651163	/nfs/dbraw/zinc/65/11/63/635651163.db2.gz	VWYKFSAYPGOSGK-CYBMUJFWSA-N	2	0	279.384	3.073	20	5		CGBDRP
C[NH+](C)C1(C)CCC([NH2+]Cc2csc([N+](=O)[O-])c2)CC1	ZINC000715585818	800140272	/nfs/dbraw/zinc/14/02/72/800140272.db2.gz	XFZBKELMPLEEAU-UHFFFAOYSA-N	2	0	297.424	3.009	20	5		CGBDRP
C[C@@H](C[N+](C)(C)C)Oc1cccc(C[NH+]2CCCCC2)c1	ZINC001229448534	932153690	/nfs/dbraw/zinc/15/36/90/932153690.db2.gz	LHANPUUWLLWBHR-INIZCTEOSA-N	2	0	291.459	3.146	20	5		CGBDRP
Cc1c([C@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)cccc1[N+](=O)[O-]	ZINC000423489957	236085421	/nfs/dbraw/zinc/08/54/21/236085421.db2.gz	XCYATVGGHSUXKS-KBPBESRZSA-N	2	0	291.395	3.086	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-]	ZINC000423458861	534226273	/nfs/dbraw/zinc/22/62/73/534226273.db2.gz	KOEXSLRHOKKMQH-KCQAQPDRSA-N	2	0	291.395	3.071	20	5		CGBDRP
CC(C)c1ccc(C[NH2+]C2CCC([NH3+])CC2)cc1[N+](=O)[O-]	ZINC000843107938	635561081	/nfs/dbraw/zinc/56/10/81/635561081.db2.gz	UWEUWVPSWPSJRY-UHFFFAOYSA-N	2	0	291.395	3.078	20	5		CGBDRP
CCC[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1	ZINC000423363944	528220400	/nfs/dbraw/zinc/22/04/00/528220400.db2.gz	OISVWBUBXNGKLQ-ZBFHGGJFSA-N	2	0	291.395	3.168	20	5		CGBDRP
C[C@@H](NCC[C@@H]1CCCC[N@@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000932181369	639289670	/nfs/dbraw/zinc/28/96/70/639289670.db2.gz	PSCSOWQCUYQCFK-HIFRSBDPSA-N	2	0	291.395	3.120	20	5		CGBDRP
Cc1c([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cccc1[N+](=O)[O-]	ZINC000423265897	236014425	/nfs/dbraw/zinc/01/44/25/236014425.db2.gz	BIHSPKGWVSJABX-GZBFAFLISA-N	2	0	291.395	3.071	20	5		CGBDRP
Cc1ccc([C@@H](C)[NH2+]C2CCC(C[NH3+])CC2)cc1[N+](=O)[O-]	ZINC000422923576	371873832	/nfs/dbraw/zinc/87/38/32/371873832.db2.gz	WQAITKLWAUGSKN-DNOWBOINSA-N	2	0	291.395	3.071	20	5		CGBDRP
Cc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)CCC[NH+](C)C	ZINC000449527922	373826622	/nfs/dbraw/zinc/82/66/22/373826622.db2.gz	LXWYTDBOHKYGFO-UHFFFAOYSA-N	2	0	293.411	3.113	20	5		CGBDRP
CCC[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423373617	393663978	/nfs/dbraw/zinc/66/39/78/393663978.db2.gz	HTKDPKCGVLKFAI-LZWOXQAQSA-N	2	0	291.395	3.296	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC([C@@H](C)[NH3+])CC1	ZINC000420304509	380844801	/nfs/dbraw/zinc/84/48/01/380844801.db2.gz	XZTNEDUSURPQHX-CHWSQXEVSA-N	2	0	291.395	3.023	20	5		CGBDRP
CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1	ZINC000020049136	170978899	/nfs/dbraw/zinc/97/88/99/170978899.db2.gz	NSBMLKSGDDMORZ-CQSZACIVSA-N	2	0	293.411	3.195	20	5		CGBDRP
CC[N+](C)(C)Cc1ccccc1NCC(C)(C)C[NH+](C)C	ZINC001168767543	807507503	/nfs/dbraw/zinc/50/75/03/807507503.db2.gz	DMHLFWFAPATBBW-UHFFFAOYSA-N	2	0	292.491	3.283	20	5		CGBDRP
CCC[C@@H]([NH2+]CC[C@H](C)[NH2+]C)c1cccc([N+](=O)[O-])c1	ZINC001326474275	934983066	/nfs/dbraw/zinc/98/30/66/934983066.db2.gz	UHTSJLZISANABV-SWLSCSKDSA-N	2	0	279.384	3.024	20	5		CGBDRP
CCC[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000591578221	346930119	/nfs/dbraw/zinc/93/01/19/346930119.db2.gz	BMKKNVAKNGLJJB-GDBMZVCRSA-N	2	0	291.395	3.168	20	5		CGBDRP
CC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000422828792	371831526	/nfs/dbraw/zinc/83/15/26/371831526.db2.gz	BGSTZUNOLKLBBU-DOMZBBRYSA-N	2	0	279.384	3.153	20	5		CGBDRP
C[C@H](CCCC[NH3+])[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000415012131	393095170	/nfs/dbraw/zinc/09/51/70/393095170.db2.gz	IQXXQTVCTGVBHX-ZIAGYGMSSA-N	2	0	293.411	3.023	20	5		CGBDRP
[NH3+]CCC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000415061930	393122391	/nfs/dbraw/zinc/12/23/91/393122391.db2.gz	ZEPYMCDXNGWQOR-KRWDZBQOSA-N	2	0	299.374	3.165	20	5		CGBDRP
CCC[C@H]([NH2+]CCCC[NH+](C)C)c1cccc([N+](=O)[O-])c1	ZINC000045663831	521155886	/nfs/dbraw/zinc/15/58/86/521155886.db2.gz	QPULPSGERBZJGF-INIZCTEOSA-N	2	0	293.411	3.367	20	5		CGBDRP
CCC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000423458147	528234539	/nfs/dbraw/zinc/23/45/39/528234539.db2.gz	PTJADKPGRISDQI-WFASDCNBSA-N	2	0	279.384	3.153	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+]CCCCCCC[NH3+])cc1[N+](=O)[O-]	ZINC000842478155	635380133	/nfs/dbraw/zinc/38/01/33/635380133.db2.gz	GCEVEQLKTCOOGM-AWEZNQCLSA-N	2	0	293.411	3.463	20	5		CGBDRP
[NH3+]CCCCCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000843340627	635649006	/nfs/dbraw/zinc/64/90/06/635649006.db2.gz	COHZAWVCIWTCEG-MRXNPFEDSA-N	2	0	291.395	3.081	20	5		CGBDRP
C[C@H](CCC[NH3+])[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000423456816	372065260	/nfs/dbraw/zinc/06/52/60/372065260.db2.gz	OHLYHHLJVCPFLV-IAQYHMDHSA-N	2	0	291.395	3.034	20	5		CGBDRP
[NH3+][C@@H]1[C@H]2C[N@@H+](Cc3c4ccccc4cc4ccccc43)C[C@H]21	ZINC001235210632	819037243	/nfs/dbraw/zinc/03/72/43/819037243.db2.gz	PGYDNLREUKZDTR-PMOLBWCYSA-N	2	0	288.394	3.382	20	5		CGBDRP
C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000593321315	347063160	/nfs/dbraw/zinc/06/31/60/347063160.db2.gz	IBWJWNCTGMOBGL-CYBMUJFWSA-N	2	0	299.374	3.165	20	5		CGBDRP
Cc1c([C@@H](C)NCC(C)(C)C[NH+](C)C)cccc1[N+](=O)[O-]	ZINC000132136924	371154982	/nfs/dbraw/zinc/15/49/82/371154982.db2.gz	SYUHWXOUHIIGAB-CYBMUJFWSA-N	2	0	293.411	3.142	20	5		CGBDRP
Cc1c([C@H](C)NCC(C)(C)C[NH+](C)C)cccc1[N+](=O)[O-]	ZINC000132137104	371155141	/nfs/dbraw/zinc/15/51/41/371155141.db2.gz	SYUHWXOUHIIGAB-ZDUSSCGKSA-N	2	0	293.411	3.142	20	5		CGBDRP
CC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000422837634	371835032	/nfs/dbraw/zinc/83/50/32/371835032.db2.gz	MPQYCRGYTQIFCG-INWMFGNUSA-N	2	0	291.395	3.024	20	5		CGBDRP
Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1	ZINC000414809041	380420744	/nfs/dbraw/zinc/42/07/44/380420744.db2.gz	LRVCOIZWAPYUPX-ZDUSSCGKSA-N	2	0	299.374	3.213	20	5		CGBDRP
CCC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000423458146	529018451	/nfs/dbraw/zinc/01/84/51/529018451.db2.gz	PTJADKPGRISDQI-SWLSCSKDSA-N	2	0	279.384	3.153	20	5		CGBDRP
CC(C)c1ccc(C[NH2+]CCCCCC[NH3+])cc1[N+](=O)[O-]	ZINC000843128538	635562488	/nfs/dbraw/zinc/56/24/88/635562488.db2.gz	MCXYFQBGPQYWDT-UHFFFAOYSA-N	2	0	293.411	3.327	20	5		CGBDRP
C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000593321943	347063203	/nfs/dbraw/zinc/06/32/03/347063203.db2.gz	JXFNXPHMPOHNFO-CYBMUJFWSA-N	2	0	299.374	3.165	20	5		CGBDRP
Cc1c([C@@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)cccc1[N+](=O)[O-]	ZINC000602022010	347934230	/nfs/dbraw/zinc/93/42/30/347934230.db2.gz	RMUUTBRXBCYFEY-MGPQQGTHSA-N	2	0	291.395	3.071	20	5		CGBDRP
CC(C)[C@@H]([NH3+])CCN(C)Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000128454277	138393996	/nfs/dbraw/zinc/39/39/96/138393996.db2.gz	PMAYUMQWZXUAOK-ZDUSSCGKSA-N	2	0	299.802	3.053	20	5		CGBDRP
CCC([NH3+])(CC)C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000414804982	380417770	/nfs/dbraw/zinc/41/77/70/380417770.db2.gz	FXSAYGKWCZKRPT-CYBMUJFWSA-N	2	0	293.411	3.023	20	5		CGBDRP
C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc([N+](=O)[O-])cc1	ZINC000423292089	533448424	/nfs/dbraw/zinc/44/84/24/533448424.db2.gz	LGTLMNWQRJHBIQ-QWHCGFSZSA-N	2	0	299.374	3.465	20	5		CGBDRP
CC[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000420398878	393481594	/nfs/dbraw/zinc/48/15/94/393481594.db2.gz	HDYGRWACIIMCAF-BBRMVZONSA-N	2	0	291.395	3.025	20	5		CGBDRP
CCC[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1	ZINC000423363934	529009390	/nfs/dbraw/zinc/00/93/90/529009390.db2.gz	OISVWBUBXNGKLQ-GDBMZVCRSA-N	2	0	291.395	3.168	20	5		CGBDRP
CCC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1cccc([N+](=O)[O-])c1	ZINC000596653513	347498393	/nfs/dbraw/zinc/49/83/93/347498393.db2.gz	LIWKMKDILRUOCZ-CVEARBPZSA-N	2	0	293.411	3.399	20	5		CGBDRP
CC(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-]	ZINC000414926502	249123970	/nfs/dbraw/zinc/12/39/70/249123970.db2.gz	NHZNGOMVXZSNOV-UONOGXRCSA-N	2	0	291.395	3.078	20	5		CGBDRP
CCC([NH3+])(CC)C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000414804983	528949515	/nfs/dbraw/zinc/94/95/15/528949515.db2.gz	FXSAYGKWCZKRPT-ZDUSSCGKSA-N	2	0	293.411	3.023	20	5		CGBDRP
CCC[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000591578224	346930295	/nfs/dbraw/zinc/93/02/95/346930295.db2.gz	BMKKNVAKNGLJJB-ZBFHGGJFSA-N	2	0	291.395	3.168	20	5		CGBDRP
CC[C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c1cccc([N+](=O)[O-])c1	ZINC000596654002	347499043	/nfs/dbraw/zinc/49/90/43/347499043.db2.gz	NGQGGWCDZFJYCT-CABCVRRESA-N	2	0	279.384	3.009	20	5		CGBDRP
C[C@@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000602020087	347934361	/nfs/dbraw/zinc/93/43/61/347934361.db2.gz	HUDWZXTUWOJWAF-TZMCWYRMSA-N	2	0	291.395	3.024	20	5		CGBDRP
CCN1CCC[C@H]1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C	ZINC000248034778	377261500	/nfs/dbraw/zinc/26/15/00/377261500.db2.gz	RIZXHGOZSJXLHS-KGLIPLIRSA-N	2	0	291.395	3.038	20	5		CGBDRP
C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc([N+](=O)[O-])cc1	ZINC000423429290	278355157	/nfs/dbraw/zinc/35/51/57/278355157.db2.gz	SHTFSBSXEPJWQH-MGPQQGTHSA-N	2	0	291.395	3.011	20	5		CGBDRP
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)CCC[NH+]1CCCC1	ZINC000299125223	373463517	/nfs/dbraw/zinc/46/35/17/373463517.db2.gz	MSIZBBGSOCDCOU-CQSZACIVSA-N	2	0	291.395	3.074	20	5		CGBDRP
CCC[C@@H](NC[C@H](C)C[NH+](C)C)c1cccc([N+](=O)[O-])c1	ZINC000336850231	376011432	/nfs/dbraw/zinc/01/14/32/376011432.db2.gz	WOTHTCZZAYHVPK-XJKSGUPXSA-N	2	0	293.411	3.223	20	5		CGBDRP
C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CCCC[NH3+]	ZINC000415012130	393094694	/nfs/dbraw/zinc/09/46/94/393094694.db2.gz	IQXXQTVCTGVBHX-UONOGXRCSA-N	2	0	293.411	3.023	20	5		CGBDRP
CC[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423334627	529616926	/nfs/dbraw/zinc/61/69/26/529616926.db2.gz	QWQHCPYEEFQAEN-HOTGVXAUSA-N	2	0	291.395	3.025	20	5		CGBDRP
CC(C)c1ccc(C[NH2+][C@@H](C)CCCC[NH3+])cc1[N+](=O)[O-]	ZINC000415019405	393100279	/nfs/dbraw/zinc/10/02/79/393100279.db2.gz	VSDUYIOAKLYKFW-ZDUSSCGKSA-N	2	0	293.411	3.325	20	5		CGBDRP
CC[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000420398881	393482644	/nfs/dbraw/zinc/48/26/44/393482644.db2.gz	HDYGRWACIIMCAF-CZUORRHYSA-N	2	0	291.395	3.025	20	5		CGBDRP
CCC[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000423409063	393666705	/nfs/dbraw/zinc/66/67/05/393666705.db2.gz	YLZQZIGGVSCXQN-KCXAZCMYSA-N	2	0	291.395	3.024	20	5		CGBDRP
C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1	ZINC000453438134	394245573	/nfs/dbraw/zinc/24/55/73/394245573.db2.gz	VOTARLSNIYQNTP-ZDUSSCGKSA-N	2	0	291.395	3.120	20	5		CGBDRP
C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000421870245	289937323	/nfs/dbraw/zinc/93/73/23/289937323.db2.gz	DWVTYAVUVAKSOM-GRTSSRMGSA-N	2	0	291.395	3.118	20	5		CGBDRP
C[C@@H]([NH2+][C@H]1C[C@H]([NH3+])CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000925825778	619273667	/nfs/dbraw/zinc/27/36/67/619273667.db2.gz	JVQAGRYMNCMPPD-XBFCOCLRSA-N	2	0	291.395	3.151	20	5		CGBDRP
CC[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000873268987	634312730	/nfs/dbraw/zinc/31/27/30/634312730.db2.gz	BOIXWIKIQKUVGN-BLLLJJGKSA-N	2	0	291.395	3.024	20	5		CGBDRP
[NH3+]CCCCCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000843340626	635648651	/nfs/dbraw/zinc/64/86/51/635648651.db2.gz	COHZAWVCIWTCEG-INIZCTEOSA-N	2	0	291.395	3.081	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+]CCCCCC[NH3+])cc1[N+](=O)[O-]	ZINC000843342614	635650290	/nfs/dbraw/zinc/65/02/90/635650290.db2.gz	NDNYNDUHBHIYBT-ZDUSSCGKSA-N	2	0	279.384	3.073	20	5		CGBDRP
[NH3+]CCCCCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000846221402	636162989	/nfs/dbraw/zinc/16/29/89/636162989.db2.gz	YVTJZOAHAFXPKY-UHFFFAOYSA-N	2	0	291.395	3.078	20	5		CGBDRP
CCCC[NH+](CCCC)CCCO[C@@H](C)C[N+](C)(C)C	ZINC001224755292	816872993	/nfs/dbraw/zinc/87/29/93/816872993.db2.gz	LYAWBEVFHIVBHO-KRWDZBQOSA-N	2	0	287.512	3.390	20	5		CGBDRP
Cc1ccc([C@@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)cc1[N+](=O)[O-]	ZINC000602023418	347933906	/nfs/dbraw/zinc/93/39/06/347933906.db2.gz	WQAITKLWAUGSKN-UMVBOHGHSA-N	2	0	291.395	3.071	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H]([C@H](C)[NH3+])C1	ZINC000420287338	292295869	/nfs/dbraw/zinc/29/58/69/292295869.db2.gz	HVRYNDIMDZHJGK-IHRRRGAJSA-N	2	0	291.395	3.023	20	5		CGBDRP
CC[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423334628	286913186	/nfs/dbraw/zinc/91/31/86/286913186.db2.gz	QWQHCPYEEFQAEN-HZPDHXFCSA-N	2	0	291.395	3.025	20	5		CGBDRP
C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1cccc([N+](=O)[O-])c1	ZINC000423424204	533910084	/nfs/dbraw/zinc/91/00/84/533910084.db2.gz	MSCKPVSYOMNOPX-IHRRRGAJSA-N	2	0	291.395	3.011	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CCCCCC[NH3+]	ZINC000872155156	634066390	/nfs/dbraw/zinc/06/63/90/634066390.db2.gz	DWDNDWPXWFINRP-AWEZNQCLSA-N	2	0	293.411	3.415	20	5		CGBDRP
O=[N+]([O-])c1cc(C[NH2+]CCCCC[NH+]2CCCC2)cs1	ZINC000293172029	372318120	/nfs/dbraw/zinc/31/81/20/372318120.db2.gz	WEBYYDMKBJDUQO-UHFFFAOYSA-N	2	0	297.424	3.012	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H]([C@@H](C)[NH3+])C1	ZINC000420287341	393450042	/nfs/dbraw/zinc/45/00/42/393450042.db2.gz	HVRYNDIMDZHJGK-RDBSUJKOSA-N	2	0	291.395	3.023	20	5		CGBDRP
C[C@@H]([NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000925825776	619273512	/nfs/dbraw/zinc/27/35/12/619273512.db2.gz	JVQAGRYMNCMPPD-KWCYVHTRSA-N	2	0	291.395	3.151	20	5		CGBDRP
CC[N+](C)(C)Cc1ccccc1NC(C)(C)CC[NH+](C)C	ZINC001169719254	807698044	/nfs/dbraw/zinc/69/80/44/807698044.db2.gz	ZQNVJFSVSLBAAL-UHFFFAOYSA-N	2	0	292.491	3.425	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CC[C@@H]([NH3+])C(C)C	ZINC000420285549	393450599	/nfs/dbraw/zinc/45/05/99/393450599.db2.gz	FBPVKKLLKLZDRL-XJKSGUPXSA-N	2	0	293.411	3.269	20	5		CGBDRP
CCC[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423492633	528242029	/nfs/dbraw/zinc/24/20/29/528242029.db2.gz	NZAYBQNMZUPGCR-INWMFGNUSA-N	2	0	291.395	3.153	20	5		CGBDRP
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCCCCC[NH3+]	ZINC001254544840	806446029	/nfs/dbraw/zinc/44/60/29/806446029.db2.gz	XYTBQMOSKFZANF-AWEZNQCLSA-N	2	0	293.411	3.025	20	5		CGBDRP
CCCC[C@H](C[NH3+])N[C@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000423303758	372049873	/nfs/dbraw/zinc/04/98/73/372049873.db2.gz	XKSASIWJMYJNKY-CJNGLKHVSA-N	2	0	291.395	3.079	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CCCCCC[NH3+]	ZINC000872155157	634065592	/nfs/dbraw/zinc/06/55/92/634065592.db2.gz	DWDNDWPXWFINRP-CQSZACIVSA-N	2	0	293.411	3.415	20	5		CGBDRP
CC(C)[PH+](CC[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)C(C)C	ZINC001169001253	807548731	/nfs/dbraw/zinc/54/87/31/807548731.db2.gz	DZGRXKOTLHOPPC-KGLIPLIRSA-N	2	0	288.372	3.320	20	5		CGBDRP
CC[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000423275396	529655767	/nfs/dbraw/zinc/65/57/67/529655767.db2.gz	NCZJBHXYXDBNLA-VNQPRFMTSA-N	2	0	291.395	3.153	20	5		CGBDRP
C[C@H](CCCC[NH3+])[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000423427104	372062595	/nfs/dbraw/zinc/06/25/95/372062595.db2.gz	IDROMQJQQNLYRM-WBMJQRKESA-N	2	0	291.395	3.079	20	5		CGBDRP
C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cccc([N+](=O)[O-])c1	ZINC000423357040	533450202	/nfs/dbraw/zinc/45/02/02/533450202.db2.gz	KYKHSEHOELQVMI-GFCCVEGCSA-N	2	0	297.358	3.049	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CC[C@H]([NH3+])C(C)C	ZINC000420285546	393449883	/nfs/dbraw/zinc/44/98/83/393449883.db2.gz	FBPVKKLLKLZDRL-CJNGLKHVSA-N	2	0	293.411	3.269	20	5		CGBDRP
CC[C@H]([NH2+]CCC1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000420416740	393486098	/nfs/dbraw/zinc/48/60/98/393486098.db2.gz	VUIDAXCIRXAYPZ-INIZCTEOSA-N	2	0	291.395	3.025	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC([C@@H](C)[NH3+])CC1	ZINC000420304510	301868156	/nfs/dbraw/zinc/86/81/56/301868156.db2.gz	XZTNEDUSURPQHX-OLZOCXBDSA-N	2	0	291.395	3.023	20	5		CGBDRP
CCC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000423458144	529021010	/nfs/dbraw/zinc/02/10/10/529021010.db2.gz	PTJADKPGRISDQI-IUODEOHRSA-N	2	0	279.384	3.153	20	5		CGBDRP
CCC[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000925876700	619304327	/nfs/dbraw/zinc/30/43/27/619304327.db2.gz	FLNDICXZYKFPEQ-INWMFGNUSA-N	2	0	291.395	3.153	20	5		CGBDRP
CC(C)[PH+](CC[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)C(C)C	ZINC001169001254	807549379	/nfs/dbraw/zinc/54/93/79/807549379.db2.gz	DZGRXKOTLHOPPC-UONOGXRCSA-N	2	0	288.372	3.320	20	5		CGBDRP
C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000593321944	347062977	/nfs/dbraw/zinc/06/29/77/347062977.db2.gz	JXFNXPHMPOHNFO-ZDUSSCGKSA-N	2	0	299.374	3.165	20	5		CGBDRP
Cc1ccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1[N+](=O)[O-]	ZINC000414802477	380414207	/nfs/dbraw/zinc/41/42/07/380414207.db2.gz	BQXCOPNXLZSDQW-ZDUSSCGKSA-N	2	0	299.374	3.213	20	5		CGBDRP
C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cccc([N+](=O)[O-])c1	ZINC000423290844	533448470	/nfs/dbraw/zinc/44/84/70/533448470.db2.gz	FRFJJBJKOPXKIR-QWHCGFSZSA-N	2	0	299.374	3.465	20	5		CGBDRP
CC[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000423324754	286903062	/nfs/dbraw/zinc/90/30/62/286903062.db2.gz	IXXJSJALQKWXBH-OAHLLOKOSA-N	2	0	291.395	3.025	20	5		CGBDRP
CCC[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423254232	528220996	/nfs/dbraw/zinc/22/09/96/528220996.db2.gz	XSBVAWRUQMEXIS-BBRMVZONSA-N	2	0	291.395	3.025	20	5		CGBDRP
C[N@H+](CCCCCC[NH3+])Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000846218098	636161175	/nfs/dbraw/zinc/16/11/75/636161175.db2.gz	SHPXAXPOKIUKLB-UHFFFAOYSA-N	2	0	299.802	3.199	20	5		CGBDRP
[NH3+]CCC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000925597346	638540191	/nfs/dbraw/zinc/54/01/91/638540191.db2.gz	YMDVTNQKMGWZCE-INIZCTEOSA-N	2	0	299.374	3.165	20	5		CGBDRP
CC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccc([N+](=O)[O-])c1	ZINC000423469166	529599936	/nfs/dbraw/zinc/59/99/36/529599936.db2.gz	CKZLRSNGLZUOJW-ZBFHGGJFSA-N	2	0	291.395	3.168	20	5		CGBDRP
CCC[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000591578223	346930303	/nfs/dbraw/zinc/93/03/03/346930303.db2.gz	BMKKNVAKNGLJJB-HOCLYGCPSA-N	2	0	291.395	3.168	20	5		CGBDRP
Cc1c([C@H](C)[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cccc1[N+](=O)[O-]	ZINC000423265896	236014404	/nfs/dbraw/zinc/01/44/04/236014404.db2.gz	BIHSPKGWVSJABX-GUTXKFCHSA-N	2	0	291.395	3.071	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000423482385	236082757	/nfs/dbraw/zinc/08/27/57/236082757.db2.gz	PBUHGXQKSGSSAR-DZGCQCFKSA-N	2	0	291.395	3.086	20	5		CGBDRP
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@H](CC[NH3+])C1	ZINC000420312118	393461278	/nfs/dbraw/zinc/46/12/78/393461278.db2.gz	OIDABRNKUBBDAC-ZIAGYGMSSA-N	2	0	291.395	3.025	20	5		CGBDRP
Cc1ccc(C[NH2+]C(C)(C)CCC[NH+](C)C)cc1[N+](=O)[O-]	ZINC000387173739	336187011	/nfs/dbraw/zinc/18/70/11/336187011.db2.gz	BTNNSEISZSSVJE-UHFFFAOYSA-N	2	0	293.411	3.113	20	5		CGBDRP
[NH3+]CCCC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000423341830	534605885	/nfs/dbraw/zinc/60/58/85/534605885.db2.gz	YCDKOTGABZWRRW-KRWDZBQOSA-N	2	0	299.374	3.013	20	5		CGBDRP
CCC[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000423373616	528236640	/nfs/dbraw/zinc/23/66/40/528236640.db2.gz	HTKDPKCGVLKFAI-FMKPAKJESA-N	2	0	291.395	3.296	20	5		CGBDRP
CC[C@@H]([NH2+]CCCCCC[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000843342312	635650143	/nfs/dbraw/zinc/65/01/43/635650143.db2.gz	JUXPDBSFARDLBR-OAHLLOKOSA-N	2	0	279.384	3.155	20	5		CGBDRP
C[C@@H]([NH2+][C@H]1C[C@@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-]	ZINC000925727664	638583743	/nfs/dbraw/zinc/58/37/43/638583743.db2.gz	BHNFBSSTNDQYOW-UPJWGTAASA-N	2	0	291.395	3.151	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+]C[C@@H](N)c2ccccc2)cc1[N+](=O)[O-]	ZINC000423234324	236004296	/nfs/dbraw/zinc/00/42/96/236004296.db2.gz	FOGQDHADDXTUCJ-XJKSGUPXSA-N	2	0	299.374	3.254	20	5		CGBDRP
Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cc1[N+](=O)[O-]	ZINC000423267327	236014574	/nfs/dbraw/zinc/01/45/74/236014574.db2.gz	FGZWVOQJRQDUEI-NWANDNLSSA-N	2	0	291.395	3.071	20	5		CGBDRP
CC(C)c1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-]	ZINC000414926500	249124097	/nfs/dbraw/zinc/12/40/97/249124097.db2.gz	NHZNGOMVXZSNOV-KGLIPLIRSA-N	2	0	291.395	3.078	20	5		CGBDRP
C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000423426836	278227598	/nfs/dbraw/zinc/22/75/98/278227598.db2.gz	IDROMQJQQNLYRM-BLLLJJGKSA-N	2	0	291.395	3.079	20	5		CGBDRP
Cc1c([C@@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)cccc1[N+](=O)[O-]	ZINC000423489960	533944267	/nfs/dbraw/zinc/94/42/67/533944267.db2.gz	XCYATVGGHSUXKS-ZIAGYGMSSA-N	2	0	291.395	3.086	20	5		CGBDRP
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCCCCC[NH3+]	ZINC001173218493	808540139	/nfs/dbraw/zinc/54/01/39/808540139.db2.gz	KDASQCZJQHZRGN-CQSZACIVSA-N	2	0	293.411	3.025	20	5		CGBDRP
CCC[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccc([N+](=O)[O-])c1	ZINC000423220305	372040079	/nfs/dbraw/zinc/04/00/79/372040079.db2.gz	XZBVGMMVVLPLOX-CJNGLKHVSA-N	2	0	291.395	3.025	20	5		CGBDRP
Cc1c([C@H](C)[NH2+][C@H](C)CCCC[NH3+])cccc1[N+](=O)[O-]	ZINC000423422712	533956210	/nfs/dbraw/zinc/95/62/10/533956210.db2.gz	DICLIASGWBCOBZ-YPMHNXCESA-N	2	0	279.384	3.071	20	5		CGBDRP
[NH3+]CCC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000415061931	534620790	/nfs/dbraw/zinc/62/07/90/534620790.db2.gz	ZEPYMCDXNGWQOR-QGZVFWFLSA-N	2	0	299.374	3.165	20	5		CGBDRP
C[C@H]([NH2+][C@@H]1C[C@H]([NH3+])CC(C)(C)C1)c1ccccc1[N+](=O)[O-]	ZINC000925632603	619098012	/nfs/dbraw/zinc/09/80/12/619098012.db2.gz	BHNFBSSTNDQYOW-RWMBFGLXSA-N	2	0	291.395	3.151	20	5		CGBDRP