smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cccc2c1C[C@]1(CCCC[N@@H+]1CCCC[NH3+])CO2	ZINC000039004138	398557928	/nfs/dbraw/zinc/55/79/28/398557928.db2.gz	TXCIYSXYJGGUBU-GOSISDBHSA-N	2	0	304.434	2.594	10	0		DFAERP
C[NH2+][C@H]1CCN(c2cc[nH+]c(NCc3ccc(F)cc3)c2)C1	ZINC000116600953	398762293	/nfs/dbraw/zinc/76/22/93/398762293.db2.gz	QIKKIPDUTBSDFG-HNNXBMFYSA-N	2	0	300.381	2.631	10	0		DFAERP
C[NH+](C)CCCNC(=O)c1cc2c(s1)C[N@@H+](C1CCCC1)C2	ZINC000065238963	184317194	/nfs/dbraw/zinc/31/71/94/184317194.db2.gz	HREJJWZJVFGWRT-UHFFFAOYSA-N	2	0	321.490	2.688	10	0		DFAERP
Cc1nc(C[NH+]2CC[C@@H]3CO[C@@H](C[N@@H+](C)C(C)C)[C@H]3C2)cs1	ZINC000503720319	257207661	/nfs/dbraw/zinc/20/76/61/257207661.db2.gz	SBUFHSUMCABGFK-PVAVHDDUSA-N	2	0	323.506	2.629	10	0		DFAERP
C[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)C[C@@H]1CCCC[C@@H]1[NH3+]	ZINC000261558174	146240808	/nfs/dbraw/zinc/24/08/08/146240808.db2.gz	XYKXIEPRFXKXEO-NJAFHUGGSA-N	2	0	317.477	2.531	10	0		DFAERP
Cc1ccc(C[N@@H+]2CC[C@H]([NH3+])C(C)(C)C2)c(-c2cnn(C)c2)c1	ZINC000261785903	146276346	/nfs/dbraw/zinc/27/63/46/146276346.db2.gz	FTZVPLQCWOOVCS-SFHVURJKSA-N	2	0	312.461	2.955	10	0		DFAERP
C[C@@H]1CCC[C@](CNC(=O)C[C@@H]2CCCC[C@@H]2[NH3+])([NH+](C)C)C1	ZINC000262521150	146366387	/nfs/dbraw/zinc/36/63/87/146366387.db2.gz	OCFNXRBVPPGPBV-CVYDXHPNSA-N	2	0	309.498	2.521	10	0		DFAERP
CC[C@@H]1CC[C@@H](C)C[C@H]1[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1	ZINC000333541690	271377797	/nfs/dbraw/zinc/37/77/97/271377797.db2.gz	IAPNCIUGQBPFST-UMVBOHGHSA-N	2	0	305.470	2.576	10	0		DFAERP
C[NH+]1CCC(C)(C[NH2+]Cc2ccc(C3OCCO3)cc2)CC1	ZINC000406017115	398694525	/nfs/dbraw/zinc/69/45/25/398694525.db2.gz	XZHVXSARUDDYJB-UHFFFAOYSA-N	2	0	304.434	2.554	10	0		DFAERP
NC(=[NH2+])c1ccc(-c2ccc(-c3ccc(C(N)=[NH2+])cn3)o2)cc1	ZINC000003819470	181046807	/nfs/dbraw/zinc/04/68/07/181046807.db2.gz	UOKQILSMWHDZGS-UHFFFAOYSA-N	2	0	305.341	2.577	10	0	in-vivo	DFAERP
[NH3+]CCC[NH2+]CCCCCCCCCCCC[NH2+]CCC[NH3+]	ZINC000141533370	398895618	/nfs/dbraw/zinc/89/56/18/398895618.db2.gz	MVCCPAUHFCORPA-UHFFFAOYSA-N	4	0	314.562	2.764	10	0		DFAERP
C[C@H](NC(=O)CN1CC[C@H]([NH3+])C(C)(C)C1)c1ccc(Cl)cc1	ZINC000261605044	146245127	/nfs/dbraw/zinc/24/51/27/146245127.db2.gz	AZILONPMWSALIH-WFASDCNBSA-N	2	0	323.868	2.576	10	0		DFAERP
Cc1ccc(NC(=O)[C@H](C)N2CC[C@H]([NH3+])C(C)(C)C2)c(C)c1	ZINC000261667421	146256682	/nfs/dbraw/zinc/25/66/82/146256682.db2.gz	IVFRSSUMMCWLSC-HOCLYGCPSA-N	2	0	303.450	2.690	10	0		DFAERP
CC1(C)C[N@H+](CCC(=O)Nc2ccc(Cl)cc2)CC[C@@H]1[NH3+]	ZINC000261879785	146293522	/nfs/dbraw/zinc/29/35/22/146293522.db2.gz	UNTQCYTZBRRXGG-AWEZNQCLSA-N	2	0	309.841	2.728	10	0		DFAERP
CC(C)C[NH+]1CCN([C@H](C[NH3+])c2c(F)cccc2Cl)CC1	ZINC000020179729	182194685	/nfs/dbraw/zinc/19/46/85/182194685.db2.gz	LSSYXZPKMQJIGU-OAHLLOKOSA-N	2	0	313.848	2.753	10	0		DFAERP
C[NH+](C)CCCCn1c(N)[nH+]c2cc(Br)ccc21	ZINC000041678340	183216195	/nfs/dbraw/zinc/21/61/95/183216195.db2.gz	SEVBMICUYXELBL-UHFFFAOYSA-N	2	0	311.227	2.723	10	0		DFAERP
C[C@H](NC(=O)CN1CC[C@@H]([NH3+])C(C)(C)C1)c1ccc(Cl)cc1	ZINC000261605042	146244883	/nfs/dbraw/zinc/24/48/83/146244883.db2.gz	AZILONPMWSALIH-SWLSCSKDSA-N	2	0	323.868	2.576	10	0		DFAERP
CC1(C)CN(Cc2c(F)cccc2N2CCCC2)CC[C@H]1[NH3+]	ZINC000261676531	146258097	/nfs/dbraw/zinc/25/80/97/146258097.db2.gz	JQILUEAWZOTYEC-QGZVFWFLSA-N	2	0	305.441	2.985	10	0		DFAERP
CC[NH+](CC)[C@@H](C(=O)N1CC[C@H]([NH3+])C(C)(C)C1)c1ccccc1	ZINC000262066358	146329890	/nfs/dbraw/zinc/32/98/90/146329890.db2.gz	SCLJMXGMNXELJB-DLBZAZTESA-N	2	0	317.477	2.655	10	0		DFAERP
NC(=[NH2+])c1ccc(NCCCCNc2ccc(C(N)=[NH2+])cc2)cc1	ZINC000005161830	181212219	/nfs/dbraw/zinc/21/22/19/181212219.db2.gz	XPYWKLXCKKLGSB-UHFFFAOYSA-N	2	0	324.432	2.559	10	0		DFAERP
[NH3+]CCCCC[NH2+]CCCCCCCC[NH2+]CCCCC[NH3+]	ZINC000213582742	399205143	/nfs/dbraw/zinc/20/51/43/399205143.db2.gz	RWGPQKSUCOMQMD-UHFFFAOYSA-N	4	0	314.562	2.764	10	0		DFAERP
CC(C)(C)[NH+]1CCN([C@@H](C[NH3+])c2ccc(Cl)s2)CC1	ZINC000042308604	183252294	/nfs/dbraw/zinc/25/22/94/183252294.db2.gz	WVWURZYOVDHNJJ-NSHDSACASA-N	2	0	301.887	2.817	10	0		DFAERP
C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)c(Br)c1	ZINC000061699553	184183965	/nfs/dbraw/zinc/18/39/65/184183965.db2.gz	KDRRUXBZQBJCNV-JTQLQIEISA-N	2	0	301.228	2.670	10	0		DFAERP
Cn1cc(CN2CC[C@@](C)(C[NH3+])C2)c(-c2ccccc2Cl)n1	ZINC000261608572	146245062	/nfs/dbraw/zinc/24/50/62/146245062.db2.gz	AZUHHQZUZVUQPA-KRWDZBQOSA-N	2	0	318.852	2.911	10	0		DFAERP
CC1(C)CN(Cc2ccc(OC[C@@H]3CCCO3)cc2)CC[C@@H]1[NH3+]	ZINC000261605069	146245073	/nfs/dbraw/zinc/24/50/73/146245073.db2.gz	BAPRJWMNJKBNBN-ROUUACIJSA-N	2	0	318.461	2.804	10	0		DFAERP
Cc1c(F)cccc1NC(=O)CC[N@@H+]1CC[C@H]([NH3+])C(C)(C)C1	ZINC000261758112	146272188	/nfs/dbraw/zinc/27/21/88/146272188.db2.gz	LPONZOLXFBNKCB-HNNXBMFYSA-N	2	0	307.413	2.522	10	0		DFAERP
C[C@H](C(=O)Nc1ccc(Cl)cc1)N1CC[C@H]([NH3+])C(C)(C)C1	ZINC000261863878	146290594	/nfs/dbraw/zinc/29/05/94/146290594.db2.gz	SLHOTOKWCAGUOL-RISCZKNCSA-N	2	0	309.841	2.726	10	0		DFAERP
CCCOc1ccc(OCC[N@@H+]2CC[C@@H]([NH3+])C(C)(C)C2)cc1	ZINC000262493775	146364916	/nfs/dbraw/zinc/36/49/16/146364916.db2.gz	LEQRPRZXURFUQR-QGZVFWFLSA-N	2	0	306.450	2.913	10	0		DFAERP
Cc1cc(N[C@@H]2CCC[NH2+]C2)nc(N2CCc3ccccc3C2)[nH+]1	ZINC000045947557	274719431	/nfs/dbraw/zinc/71/94/31/274719431.db2.gz	RIYCMRCEJXAUMX-QGZVFWFLSA-N	2	0	323.444	2.512	10	0		DFAERP
CCC(CC)[C@@H](CNC(=O)c1ccc(C[NH3+])cc1)[NH+]1CCCC1	ZINC000236667529	201956449	/nfs/dbraw/zinc/95/64/49/201956449.db2.gz	UQDKOXOIPIDLJZ-GOSISDBHSA-N	2	0	317.477	2.776	10	0		DFAERP
C[NH2+]C[C@@H](C)C(=O)Nc1cccc2c1C[N@H+](CCC(C)C)C2	ZINC000237268407	202211718	/nfs/dbraw/zinc/21/17/18/202211718.db2.gz	RISGJBNVAWFGTH-CQSZACIVSA-N	2	0	303.450	2.842	10	0		DFAERP
CC(C)(C)[NH+]1CCN([C@H](C[NH3+])c2ccc(Cl)s2)CC1	ZINC000042308606	183252564	/nfs/dbraw/zinc/25/25/64/183252564.db2.gz	WVWURZYOVDHNJJ-LLVKDONJSA-N	2	0	301.887	2.817	10	0		DFAERP
Cc1cccc(C[NH+]2CC[C@@H]3[C@@H](CO[C@@H]3C[N@@H+](C)C(C)C)C2)n1	ZINC000503717727	257208108	/nfs/dbraw/zinc/20/81/08/257208108.db2.gz	AGQIIPAFGUAVFK-BHIYHBOVSA-N	2	0	317.477	2.567	10	0		DFAERP
[NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12	ZINC000261548160	146240080	/nfs/dbraw/zinc/24/00/80/146240080.db2.gz	NFBCHLNNXHECSR-LJDSDSDDSA-N	3	0	313.489	2.614	10	0		DFAERP
CC1(C)CN(Cc2ccc(OC[C@H]3CCCO3)cc2)CC[C@H]1[NH3+]	ZINC000261605068	146245010	/nfs/dbraw/zinc/24/50/10/146245010.db2.gz	BAPRJWMNJKBNBN-QZTJIDSGSA-N	2	0	318.461	2.804	10	0		DFAERP
CC(C)c1noc([C@@]23CCC[C@@H]2C[N@H+](C[C@H]2CCC[NH2+]C2)C3)n1	ZINC000261614770	146247493	/nfs/dbraw/zinc/24/74/93/146247493.db2.gz	BFAHZABJYMCHCB-HDMKZQKVSA-N	2	0	318.465	2.546	10	0		DFAERP
Cc1ccc(NC(=O)[C@H](C)N2CC[C@@H]([NH3+])C(C)(C)C2)cc1F	ZINC000261667242	146256639	/nfs/dbraw/zinc/25/66/39/146256639.db2.gz	ISTRZSOAGRNMBM-SWLSCSKDSA-N	2	0	307.413	2.520	10	0		DFAERP
Cc1ccc(NC(=O)[C@@H](C)N2CC[C@@H]([NH3+])C(C)(C)C2)cc1F	ZINC000261667240	146256862	/nfs/dbraw/zinc/25/68/62/146256862.db2.gz	ISTRZSOAGRNMBM-IUODEOHRSA-N	2	0	307.413	2.520	10	0		DFAERP
Cn1cc(-c2ccc(C[N@@H+]3CC[C@H]([NH3+])C(C)(C)C3)s2)cn1	ZINC000261997975	146319148	/nfs/dbraw/zinc/31/91/48/146319148.db2.gz	SZQULYVVIFNZHO-HNNXBMFYSA-N	2	0	304.463	2.708	10	0		DFAERP
Cn1cc(-c2ccc(C[N@@H+]3CC[C@@H]([NH3+])C(C)(C)C3)s2)cn1	ZINC000261997978	146319596	/nfs/dbraw/zinc/31/95/96/146319596.db2.gz	SZQULYVVIFNZHO-OAHLLOKOSA-N	2	0	304.463	2.708	10	0		DFAERP
CC(C)c1ccc(NC(=O)CN2CC[C@@H]([NH3+])C(C)(C)C2)cc1	ZINC000262524995	146367857	/nfs/dbraw/zinc/36/78/57/146367857.db2.gz	OSFFOAHTDSXZNC-MRXNPFEDSA-N	2	0	303.450	2.808	10	0		DFAERP
C[C@H](C[NH+](C)C)n1c2ccccc2nc1CC[NH+]1CCCC1	ZINC000002017849	425588101	/nfs/dbraw/zinc/58/81/01/425588101.db2.gz	MPLFXTFWVDXPQC-OAHLLOKOSA-N	2	0	300.450	2.797	10	0		DFAERP
Cc1nccn1C[C@H](C)[NH2+]CC1CC[NH+](C2CCCC2)CC1	ZINC000065404264	282215872	/nfs/dbraw/zinc/21/58/72/282215872.db2.gz	VHUYFVQZZGNYBV-HNNXBMFYSA-N	2	0	304.482	2.824	10	0		DFAERP
On1ccc(=[NH+]CCC[NH+]2CCCC2)c2ccc(Cl)cc21	ZINC000255971352	202914496	/nfs/dbraw/zinc/91/44/96/202914496.db2.gz	FFUXOVHDZCUSFI-UHFFFAOYSA-N	2	0	305.809	2.919	10	0		DFAERP
CC[NH+]1CCN([C@H](C[NH3+])c2ccc(Cl)c(Cl)c2)CC1	ZINC000019861952	182157746	/nfs/dbraw/zinc/15/77/46/182157746.db2.gz	MDOVOHLHEYZRET-CQSZACIVSA-N	2	0	302.249	2.631	10	0		DFAERP
CN(CCC[NH+](C)C)[C@@H]1CCC[N@H+](CCCc2ccccc2)C1	ZINC000020919670	182253631	/nfs/dbraw/zinc/25/36/31/182253631.db2.gz	IWUDLLLXTYXDOV-HXUWFJFHSA-N	2	0	317.521	2.967	10	0		DFAERP
CCO[C@@H](C[NH3+])CC[N@H+](C)Cc1cccc(Br)c1	ZINC000062741005	184252207	/nfs/dbraw/zinc/25/22/07/184252207.db2.gz	ABPOSSHVMRDUBF-CQSZACIVSA-N	2	0	315.255	2.635	10	0		DFAERP
Cc1nccn1C[C@@H](C)[NH2+]CC1CC[NH+](C2CCCC2)CC1	ZINC000065404263	184338022	/nfs/dbraw/zinc/33/80/22/184338022.db2.gz	VHUYFVQZZGNYBV-OAHLLOKOSA-N	2	0	304.482	2.824	10	0		DFAERP
[NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21	ZINC000261548163	146239987	/nfs/dbraw/zinc/23/99/87/146239987.db2.gz	NFBCHLNNXHECSR-VYJAJWGXSA-N	3	0	313.489	2.614	10	0		DFAERP
Cc1ccc(NC(=O)[C@@H](C)N2CC[C@H]([NH3+])C(C)(C)C2)c(C)c1	ZINC000261667424	146256972	/nfs/dbraw/zinc/25/69/72/146256972.db2.gz	IVFRSSUMMCWLSC-ZBFHGGJFSA-N	2	0	303.450	2.690	10	0		DFAERP
Cc1ccc(C[N@@H+]2CC[C@@H]([NH3+])C(C)(C)C2)c(-c2cnn(C)c2)c1	ZINC000261785891	146276415	/nfs/dbraw/zinc/27/64/15/146276415.db2.gz	FTZVPLQCWOOVCS-GOSISDBHSA-N	2	0	312.461	2.955	10	0		DFAERP
C[NH+]1CCC(c2ccccc2)(c2cc(CC[NH3+])ccc2O)CC1	ZINC000584641898	337380128	/nfs/dbraw/zinc/38/01/28/337380128.db2.gz	UDCQDQXLDLUPFP-UHFFFAOYSA-N	2	0	310.441	2.905	10	0		DFAERP
Cc1cc(CC[NH3+])ccc1N1CC[NH+](Cc2ccccc2)CC1	ZINC000071666352	191001808	/nfs/dbraw/zinc/00/18/08/191001808.db2.gz	KSEKRHMOJBMSOO-UHFFFAOYSA-N	2	0	309.457	2.818	10	0		DFAERP
CC[NH+]1CCN([C@@H](C[NH3+])c2c(Cl)cccc2Cl)CC1	ZINC000019861958	182157939	/nfs/dbraw/zinc/15/79/39/182157939.db2.gz	DNGYIAYLCQSALM-ZDUSSCGKSA-N	2	0	302.249	2.631	10	0		DFAERP
CCOc1c(CN2CC[C@@H]([NH3+])C(C)(C)C2)c(C)nn1CC(C)C	ZINC000261609244	146245668	/nfs/dbraw/zinc/24/56/68/146245668.db2.gz	BSSMEPYHYLSPOZ-MRXNPFEDSA-N	2	0	322.497	2.805	10	0		DFAERP
Cc1cc(N[C@H]2CCC[NH2+]C2)nc(N2CCc3ccccc3C2)[nH+]1	ZINC000045947561	274719879	/nfs/dbraw/zinc/71/98/79/274719879.db2.gz	RIYCMRCEJXAUMX-KRWDZBQOSA-N	2	0	323.444	2.512	10	0		DFAERP
CC(C)[NH+]1CCN(c2ccc(-c3ccc(C[NH3+])cc3)cn2)CC1	ZINC000088343391	398434713	/nfs/dbraw/zinc/43/47/13/398434713.db2.gz	LIFORQBUDPQORQ-UHFFFAOYSA-N	2	0	310.445	2.738	10	0		DFAERP
C[NH2+]C[C@H](C)C(=O)Nc1cccc2c1C[N@H+](CCC(C)C)C2	ZINC000237089107	202150340	/nfs/dbraw/zinc/15/03/40/202150340.db2.gz	RISGJBNVAWFGTH-AWEZNQCLSA-N	2	0	303.450	2.842	10	0		DFAERP
Cc1nc(C[NH+]2CC[C@@H]3CO[C@@H](C[N@@H+](C)C(C)C)[C@@H]3C2)cs1	ZINC000248024833	257110828	/nfs/dbraw/zinc/11/08/28/257110828.db2.gz	SBUFHSUMCABGFK-OIISXLGYSA-N	2	0	323.506	2.629	10	0		DFAERP
C[C@H](c1nc(Cc2ccc(F)cc2)no1)N1CC[C@](C)(C[NH3+])C1	ZINC000261603126	146243475	/nfs/dbraw/zinc/24/34/75/146243475.db2.gz	ADYBTDBXUUGBDE-SJKOYZFVSA-N	2	0	318.396	2.531	10	0		DFAERP
CC1(C)CN(Cc2ccc(OC[C@H]3CCCO3)cc2)CC[C@@H]1[NH3+]	ZINC000261605067	146246014	/nfs/dbraw/zinc/24/60/14/146246014.db2.gz	BAPRJWMNJKBNBN-MSOLQXFVSA-N	2	0	318.461	2.804	10	0		DFAERP
CC[NH+](CC)[C@@H](CNC(=O)[C@@H]1CCC[C@@H]1C[NH3+])c1ccccc1	ZINC000262009953	146322362	/nfs/dbraw/zinc/32/23/62/146322362.db2.gz	WINZATVMULRDOI-KURKYZTESA-N	2	0	317.477	2.561	10	0		DFAERP
NC(=[NH2+])c1ccc2cc(C(=O)Nc3ccc(C[NH3+])cc3)ccc2c1	ZINC000002047485	180907930	/nfs/dbraw/zinc/90/79/30/180907930.db2.gz	NLBDETRVUYOIHQ-UHFFFAOYSA-N	2	0	318.380	2.835	10	0	in-vivo	DFAERP
C[NH+](C)[C@@H]1CCN([C@@H](C[NH3+])c2cccc(Cl)c2Cl)C1	ZINC000062964657	184262897	/nfs/dbraw/zinc/26/28/97/184262897.db2.gz	BOZHKRUEBGOOSS-MFKMUULPSA-N	2	0	302.249	2.629	10	0		DFAERP
CC(C)C[NH2+]CCCC[NH+]1CCN(Cc2ccccc2)CC1	ZINC000120865683	195253650	/nfs/dbraw/zinc/25/36/50/195253650.db2.gz	IQWYVBLHMKJQPY-UHFFFAOYSA-N	2	0	303.494	2.830	10	0		DFAERP
Cc1ccc(NC(=O)CN2CC[C@H]([NH3+])C(C)(C)C2)cc1Cl	ZINC000261785942	146275748	/nfs/dbraw/zinc/27/57/48/146275748.db2.gz	XJOAQCAAGLUMHN-AWEZNQCLSA-N	2	0	309.841	2.646	10	0		DFAERP
CC1(C)CN([C@@H]2CCN(c3cccc(Cl)c3)C2=O)CC[C@H]1[NH3+]	ZINC000261905580	146298824	/nfs/dbraw/zinc/29/88/24/146298824.db2.gz	WYSBXXGJLQWUEJ-HUUCEWRRSA-N	2	0	321.852	2.505	10	0		DFAERP
CN(CC[NH2+]Cc1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000307409624	398511642	/nfs/dbraw/zinc/51/16/42/398511642.db2.gz	IFYNQLPJACJCAM-NRFANRHFSA-N	2	0	323.484	2.983	10	0		DFAERP
CC[NH+](CC)CCOc1ccc(Br)cc1C[NH3+]	ZINC000020483467	182223022	/nfs/dbraw/zinc/22/30/22/182223022.db2.gz	GDCDGEIEZSBNKS-UHFFFAOYSA-N	2	0	301.228	2.628	10	0		DFAERP
CC[NH+](CC)C[C@@H]1CCCC[C@H]1NC(=O)C[C@@H]1CCC[C@H]1[NH3+]	ZINC000261875878	284687299	/nfs/dbraw/zinc/68/72/99/284687299.db2.gz	YMJLXSWKJZDYGY-MWDXBVQZSA-N	2	0	309.498	2.521	10	0		DFAERP
CC(C)[N@H+](C)C[C@@H]1C[C@H]2C[NH+](Cc3ccc(F)cc3)C[C@H]2O1	ZINC000247959569	257112739	/nfs/dbraw/zinc/11/27/39/257112739.db2.gz	DTNQTCQGPOCXDI-RYQLBKOJSA-N	2	0	306.425	2.755	10	0		DFAERP
C[NH+](C)CCn1cccc1[C@@H]([NH3+])c1ccc(Br)cc1	ZINC000011848791	425713531	/nfs/dbraw/zinc/71/35/31/425713531.db2.gz	DNSCGJFCTRMXEA-HNNXBMFYSA-N	2	0	322.250	2.860	10	0		DFAERP
CCC(CC)[C@H](CNC(=O)[C@H]1CCC[C@H]([NH3+])C1)[NH+]1CCCC1	ZINC000262681423	427368648	/nfs/dbraw/zinc/36/86/48/427368648.db2.gz	XJFDDFNCVNMOHW-ULQDDVLXSA-N	2	0	309.498	2.521	10	0		DFAERP
CCc1cccc(NC(=O)C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)c1	ZINC000261767124	535897824	/nfs/dbraw/zinc/89/78/24/535897824.db2.gz	QNIMWNJWGQLXCH-SFHVURJKSA-N	2	0	315.461	2.652	10	0		DFAERP
CN(CC[NH+](C)C)[C@H]1CCC[N@H+](Cc2ccccc2Cl)C1	ZINC000019225024	182108017	/nfs/dbraw/zinc/10/80/17/182108017.db2.gz	UIZGRCIGJJHKOT-INIZCTEOSA-N	2	0	309.885	2.798	10	0		DFAERP
C[NH+](C)CC1CCN([C@H](C[NH3+])c2ccc(Cl)s2)CC1	ZINC000042391906	183263455	/nfs/dbraw/zinc/26/34/55/183263455.db2.gz	DRHXKOXOTMPSEL-GFCCVEGCSA-N	2	0	301.887	2.675	10	0		DFAERP
C[NH+](C)[C@H]1CCN([C@@H](C[NH3+])c2cccc(Cl)c2Cl)C1	ZINC000062964658	184263015	/nfs/dbraw/zinc/26/30/15/184263015.db2.gz	BOZHKRUEBGOOSS-GWCFXTLKSA-N	2	0	302.249	2.629	10	0		DFAERP
Cc1ccc(NC(=O)[C@@H](C)N2CC[C@H]([NH3+])C(C)(C)C2)cc1F	ZINC000261667237	146256995	/nfs/dbraw/zinc/25/69/95/146256995.db2.gz	ISTRZSOAGRNMBM-DOMZBBRYSA-N	2	0	307.413	2.520	10	0		DFAERP
CC1(C)CN(Cc2c(F)cccc2N2CCCC2)CC[C@@H]1[NH3+]	ZINC000261676528	146257961	/nfs/dbraw/zinc/25/79/61/146257961.db2.gz	JQILUEAWZOTYEC-KRWDZBQOSA-N	2	0	305.441	2.985	10	0		DFAERP
COc1cc2c(cc1OCCC[NH+]1CCCC1)NC(=[NH2+])C2(C)C	ZINC000103245002	425941059	/nfs/dbraw/zinc/94/10/59/425941059.db2.gz	CYTHNKDOLVBSLE-UHFFFAOYSA-N	2	0	317.433	2.840	10	0		DFAERP
[NH3+]CC[C@H]1C[N@H+](Cc2ccccc2)CCN1Cc1ccccc1	ZINC000261367051	398428702	/nfs/dbraw/zinc/42/87/02/398428702.db2.gz	FBTMYVBLVCQSMC-FQEVSTJZSA-N	2	0	309.457	2.722	10	0		DFAERP
COc1cccc2c1C[C@@]1(CCCC[N@@H+]1CCCC[NH3+])CO2	ZINC000039004137	398558166	/nfs/dbraw/zinc/55/81/66/398558166.db2.gz	TXCIYSXYJGGUBU-SFHVURJKSA-N	2	0	304.434	2.594	10	0		DFAERP
CC[NH+](CC)CCOc1ccc(C[NH2+]C)cc1Br	ZINC000019777177	182147644	/nfs/dbraw/zinc/14/76/44/182147644.db2.gz	BDPJHNLRKZUMAS-UHFFFAOYSA-N	2	0	315.255	2.889	10	0		DFAERP
CC[NH+]1CCN([C@@H](C[NH3+])c2ccc(Cl)c(Cl)c2)CC1	ZINC000019861950	182157733	/nfs/dbraw/zinc/15/77/33/182157733.db2.gz	MDOVOHLHEYZRET-AWEZNQCLSA-N	2	0	302.249	2.631	10	0		DFAERP
CC[NH+]1CCN([C@H](C[NH3+])c2c(Cl)cccc2Cl)CC1	ZINC000019861960	182157981	/nfs/dbraw/zinc/15/79/81/182157981.db2.gz	DNGYIAYLCQSALM-CYBMUJFWSA-N	2	0	302.249	2.631	10	0		DFAERP
CC(C)C[NH+]1CCN([C@@H](C[NH3+])c2c(F)cccc2Cl)CC1	ZINC000020179727	182194521	/nfs/dbraw/zinc/19/45/21/182194521.db2.gz	LSSYXZPKMQJIGU-HNNXBMFYSA-N	2	0	313.848	2.753	10	0		DFAERP
CC[C@H]([NH3+])[C@H](c1ccc(Cl)s1)N1CC[C@H]([NH+](C)C)C1	ZINC000062963993	184262810	/nfs/dbraw/zinc/26/28/10/184262810.db2.gz	LLHCPGDLPUOFEB-COPLHBTASA-N	2	0	301.887	2.816	10	0		DFAERP
[NH3+]CCCCCC[NH2+]CCCCCC[NH2+]CCCCCC[NH3+]	ZINC000005113145	398350710	/nfs/dbraw/zinc/35/07/10/398350710.db2.gz	AXLNDSRCNIVHRU-UHFFFAOYSA-N	4	0	314.562	2.764	10	0		DFAERP
C[NH2+]Cc1cc(Br)ccc1OCC[NH+]1CCCC1	ZINC000019777132	182147965	/nfs/dbraw/zinc/14/79/65/182147965.db2.gz	CDQUXHYFMPMOMR-UHFFFAOYSA-N	2	0	313.239	2.643	10	0		DFAERP
C[C@H]([NH3+])c1ccc(OC2CC[NH+](C)CC2)c(Br)c1	ZINC000061699693	184184015	/nfs/dbraw/zinc/18/40/15/184184015.db2.gz	UGWNIIQJDONJBE-JTQLQIEISA-N	2	0	313.239	2.942	10	0		DFAERP
CC(C)[N@H+](C)C[C@@H]1C[C@@H]2C[NH+](Cc3ccc(F)cc3)C[C@@H]2O1	ZINC000503716185	257209949	/nfs/dbraw/zinc/20/99/49/257209949.db2.gz	DTNQTCQGPOCXDI-NJAFHUGGSA-N	2	0	306.425	2.755	10	0		DFAERP
Cn1cc(CN2CC[C@](C)(C[NH3+])C2)c(-c2ccccc2Cl)n1	ZINC000261608574	146245983	/nfs/dbraw/zinc/24/59/83/146245983.db2.gz	AZUHHQZUZVUQPA-QGZVFWFLSA-N	2	0	318.852	2.911	10	0		DFAERP
CC1(C)C[N@H+](CCC(=O)Nc2ccccc2Cl)CC[C@@H]1[NH3+]	ZINC000261702217	146262106	/nfs/dbraw/zinc/26/21/06/146262106.db2.gz	OGXWGCWSTVWLFV-AWEZNQCLSA-N	2	0	309.841	2.728	10	0		DFAERP
CC1(C)CN([C@H]2CCN(c3cccc(Cl)c3)C2=O)CC[C@@H]1[NH3+]	ZINC000261905577	146299400	/nfs/dbraw/zinc/29/94/00/146299400.db2.gz	WYSBXXGJLQWUEJ-GJZGRUSLSA-N	2	0	321.852	2.505	10	0		DFAERP
CC(C)c1noc([C@@]23CCC[C@@H]2C[N@H+](C[C@]2(C)CC[NH2+]C2)C3)n1	ZINC000261961669	146309742	/nfs/dbraw/zinc/30/97/42/146309742.db2.gz	HHWZFLYHYQOWNB-ZTFGCOKTSA-N	2	0	318.465	2.546	10	0		DFAERP
C[N@H+](CCOc1cccc(C[NH2+]CC2CC2)c1)C1CCOCC1	ZINC000237202056	202186557	/nfs/dbraw/zinc/18/65/57/202186557.db2.gz	PRVPDWCQIYIOLG-UHFFFAOYSA-N	2	0	318.461	2.676	10	0		DFAERP
CCC[NH+]1CCN([C@H](c2ccc(Cl)s2)[C@@H](C)[NH3+])CC1	ZINC000044418582	183409016	/nfs/dbraw/zinc/40/90/16/183409016.db2.gz	SNDLFYQFVHCSAB-RISCZKNCSA-N	2	0	301.887	2.817	10	0		DFAERP
[NH3+]C[C@@H](c1c(F)cccc1Cl)N1CC[NH+](CC2CC2)CC1	ZINC000020179733	182194517	/nfs/dbraw/zinc/19/45/17/182194517.db2.gz	SPHJBZHNHODIBU-HNNXBMFYSA-N	2	0	311.832	2.507	10	0		DFAERP
CC[NH2+]C[C@H]1CC[C@@H](C[N@H+](C)Cc2ccc(Cl)s2)O1	ZINC000052509165	183862389	/nfs/dbraw/zinc/86/23/89/183862389.db2.gz	BZMGFSFADIZSGY-NEPJUHHUSA-N	2	0	302.871	2.990	10	0		DFAERP
CC1(C)CN(Cc2cnc(-c3ccncc3)s2)CC[C@@H]1[NH3+]	ZINC000261604818	146245365	/nfs/dbraw/zinc/24/53/65/146245365.db2.gz	ALUPRSZMBBWMNY-AWEZNQCLSA-N	2	0	302.447	2.764	10	0		DFAERP
C[C@@H](NC(=O)CN1CC[C@@H]([NH3+])C(C)(C)C1)c1ccc(Cl)cc1	ZINC000261605040	146245593	/nfs/dbraw/zinc/24/55/93/146245593.db2.gz	AZILONPMWSALIH-IUODEOHRSA-N	2	0	323.868	2.576	10	0		DFAERP
CC1(C)CN(Cc2cnc(-c3ccccn3)s2)CC[C@@H]1[NH3+]	ZINC000261678475	146257619	/nfs/dbraw/zinc/25/76/19/146257619.db2.gz	JVBPEQBBTSJNKZ-AWEZNQCLSA-N	2	0	302.447	2.764	10	0		DFAERP
CN(CC[NH2+]Cc1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000307409625	398511631	/nfs/dbraw/zinc/51/16/31/398511631.db2.gz	IFYNQLPJACJCAM-OAQYLSRUSA-N	2	0	323.484	2.983	10	0		DFAERP
CC[NH+](CC)CCCn1c2ccc(Cl)cc2nc1CC[NH3+]	ZINC000040403956	183061340	/nfs/dbraw/zinc/06/13/40/183061340.db2.gz	VBYLQCSNPBGIQX-UHFFFAOYSA-N	2	0	308.857	2.923	10	0		DFAERP
C[C@H]([NH3+])c1ccc(OCCC[NH+](C)C)c(Br)c1	ZINC000061699617	184184003	/nfs/dbraw/zinc/18/40/03/184184003.db2.gz	IXQMITOPWPQXAT-JTQLQIEISA-N	2	0	301.228	2.799	10	0		DFAERP
Cc1ccc(NC(=O)[C@H](C)N2CC[C@@H]([NH3+])C(C)(C)C2)c(C)c1	ZINC000261667419	146257242	/nfs/dbraw/zinc/25/72/42/146257242.db2.gz	IVFRSSUMMCWLSC-GOEBONIOSA-N	2	0	303.450	2.690	10	0		DFAERP
CC1(C)C[N@H+](CCC(=O)Nc2ccc(Cl)cc2)CC[C@H]1[NH3+]	ZINC000261879787	146293454	/nfs/dbraw/zinc/29/34/54/146293454.db2.gz	UNTQCYTZBRRXGG-CQSZACIVSA-N	2	0	309.841	2.728	10	0		DFAERP
CC1(C)CN(Cc2c[nH]nc2-c2ccccc2F)CC[C@H]1[NH3+]	ZINC000261900625	146297710	/nfs/dbraw/zinc/29/77/10/146297710.db2.gz	WMFRTMCYTGSQIE-OAHLLOKOSA-N	2	0	302.397	2.775	10	0		DFAERP
[NH3+]CC[C@@H]1C[N@H+](Cc2ccccc2)CCN1Cc1ccccc1	ZINC000196216752	426542873	/nfs/dbraw/zinc/54/28/73/426542873.db2.gz	FBTMYVBLVCQSMC-HXUWFJFHSA-N	2	0	309.457	2.722	10	0		DFAERP
[NH3+]CCC[C@@H]([NH3+])c1ccc(Br)c(Br)c1	ZINC000575438607	430084591	/nfs/dbraw/zinc/08/45/91/430084591.db2.gz	MEFZLTRJGFPJNT-SNVBAGLBSA-N	2	0	322.044	2.950	10	0		DFAERP
C[NH+](C)CCC[NH+]1CCC(C[NH3+])(CCc2ccccc2)CC1	ZINC000219253089	398346546	/nfs/dbraw/zinc/34/65/46/398346546.db2.gz	XVFKWFCEAIOEQJ-UHFFFAOYSA-N	3	0	303.494	2.612	10	0		DFAERP
[NH3+]CCc1c(F)cccc1N1CC[NH+](Cc2ccccc2)CC1	ZINC000071670361	191002851	/nfs/dbraw/zinc/00/28/51/191002851.db2.gz	MCXHUQNMBHZTOD-UHFFFAOYSA-N	2	0	313.420	2.649	10	0		DFAERP
CN(CC[NH+](C)C)[C@@H]1CCC[N@H+](Cc2ccccc2Cl)C1	ZINC000019225021	182108116	/nfs/dbraw/zinc/10/81/16/182108116.db2.gz	UIZGRCIGJJHKOT-MRXNPFEDSA-N	2	0	309.885	2.798	10	0		DFAERP
C[NH2+]Cc1nc2cc(C(F)(F)F)ccc2n1CCC[NH+](C)C	ZINC000040404369	183062066	/nfs/dbraw/zinc/06/20/66/183062066.db2.gz	GNUSPLRRTVZCOL-UHFFFAOYSA-N	2	0	314.355	2.726	10	0		DFAERP
CC[C@@H]([NH3+])[C@H](c1ccc(Cl)s1)N1CC[C@H]([NH+](C)C)C1	ZINC000062963994	184263200	/nfs/dbraw/zinc/26/32/00/184263200.db2.gz	LLHCPGDLPUOFEB-MISXGVKJSA-N	2	0	301.887	2.816	10	0		DFAERP
CC[NH+](CC)[C@@H](C(=O)N1CC[C@@H]([NH3+])C(C)(C)C1)c1ccccc1	ZINC000262066361	146329479	/nfs/dbraw/zinc/32/94/79/146329479.db2.gz	SCLJMXGMNXELJB-IAGOWNOFSA-N	2	0	317.477	2.655	10	0		DFAERP
CCC(CC)[C@H](CNC(=O)[C@@H]1CCC[C@H]([NH3+])C1)[NH+]1CCCC1	ZINC000262681421	427367571	/nfs/dbraw/zinc/36/75/71/427367571.db2.gz	XJFDDFNCVNMOHW-IKGGRYGDSA-N	2	0	309.498	2.521	10	0		DFAERP
CC[NH+]1CCN([C@H](C[NH3+])c2ccc(Cl)cc2Cl)CC1	ZINC000019861932	182157858	/nfs/dbraw/zinc/15/78/58/182157858.db2.gz	UGGSRZVOWMLODJ-CQSZACIVSA-N	2	0	302.249	2.631	10	0		DFAERP
CC[NH+](CC)CCn1c2ccc(C(F)(F)F)cc2nc1C[NH3+]	ZINC000040405727	183061992	/nfs/dbraw/zinc/06/19/92/183061992.db2.gz	VFGDSIODWFCDHX-UHFFFAOYSA-N	2	0	314.355	2.856	10	0		DFAERP
CC[NH+](CC)CCn1c2cc(Cl)ccc2nc1CCC[NH3+]	ZINC000040405779	183062269	/nfs/dbraw/zinc/06/22/69/183062269.db2.gz	STYCUFSBOUQMRD-UHFFFAOYSA-N	2	0	308.857	2.923	10	0		DFAERP
C[C@@H]([NH3+])c1ccc(OC2CC[NH+](C)CC2)c(Br)c1	ZINC000061699694	184184019	/nfs/dbraw/zinc/18/40/19/184184019.db2.gz	UGWNIIQJDONJBE-SNVBAGLBSA-N	2	0	313.239	2.942	10	0		DFAERP
CC(C)[N@H+](C)C[C@@H]1C[C@H]2C[NH+](Cc3ccc(F)cc3)C[C@@H]2O1	ZINC000503716186	257209359	/nfs/dbraw/zinc/20/93/59/257209359.db2.gz	DTNQTCQGPOCXDI-SZMVWBNQSA-N	2	0	306.425	2.755	10	0		DFAERP
CC(C)[N@H+](C)C[C@@H]1C[C@@H]2C[NH+](Cc3ccc(F)cc3)C[C@H]2O1	ZINC000503716184	257209971	/nfs/dbraw/zinc/20/99/71/257209971.db2.gz	DTNQTCQGPOCXDI-BPQIPLTHSA-N	2	0	306.425	2.755	10	0		DFAERP
FC(F)(F)c1c[nH]c(C2CC[NH+](CC3CC[NH2+]CC3)CC2)n1	ZINC000262252971	146346102	/nfs/dbraw/zinc/34/61/02/146346102.db2.gz	QHPNKTMOVQJPQD-UHFFFAOYSA-N	2	0	316.371	2.608	10	0		DFAERP
CC[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1	ZINC000333541686	271377847	/nfs/dbraw/zinc/37/78/47/271377847.db2.gz	IAPNCIUGQBPFST-NFAWXSAZSA-N	2	0	305.470	2.576	10	0		DFAERP
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1	ZINC000333640861	271382453	/nfs/dbraw/zinc/38/24/53/271382453.db2.gz	XGVFRAJPTMOYJF-VNQPRFMTSA-N	2	0	319.497	2.822	10	0		DFAERP
C[NH+](C)CCC(C[NH3+])(CC[NH+](C)C)c1cccc2ccccc21	ZINC000584615845	337372872	/nfs/dbraw/zinc/37/28/72/337372872.db2.gz	JZIJIAJXIOBBEH-UHFFFAOYSA-N	3	0	313.489	2.940	10	0		DFAERP
C[NH+](C)CCCn1c2ccccc2nc1CC[NH+]1CCCC1	ZINC000002016517	180906084	/nfs/dbraw/zinc/90/60/84/180906084.db2.gz	AUICYWPZDBWKJA-UHFFFAOYSA-N	2	0	300.450	2.626	10	0		DFAERP
CN(CC[NH+](C)C)[C@@H]1CCC[N@H+](CCCc2ccccc2)C1	ZINC000019771208	182145449	/nfs/dbraw/zinc/14/54/49/182145449.db2.gz	MFELLWVUFSFTBC-LJQANCHMSA-N	2	0	303.494	2.577	10	0		DFAERP
C[NH+](C)CCCn1c2ccc(C(F)(F)F)cc2nc1CC[NH3+]	ZINC000040404414	183062257	/nfs/dbraw/zinc/06/22/57/183062257.db2.gz	DLFFLABFOHDMPW-UHFFFAOYSA-N	2	0	314.355	2.508	10	0		DFAERP
CCO[C@H](C[NH3+])CC[N@H+](C)Cc1cccc(Br)c1	ZINC000062741004	184252217	/nfs/dbraw/zinc/25/22/17/184252217.db2.gz	ABPOSSHVMRDUBF-AWEZNQCLSA-N	2	0	315.255	2.635	10	0		DFAERP
Cc1cccc(C[NH+]2CC[C@@H]3[C@H](CO[C@@H]3C[N@@H+](C)C(C)C)C2)n1	ZINC000503717728	257208791	/nfs/dbraw/zinc/20/87/91/257208791.db2.gz	AGQIIPAFGUAVFK-QXAKKESOSA-N	2	0	317.477	2.567	10	0		DFAERP
CC(C)CN(CC[NH+](C)C)[C@H](C[NH3+])c1ccc(Cl)s1	ZINC000042744406	183304931	/nfs/dbraw/zinc/30/49/31/183304931.db2.gz	WIKDLDJLRBVASE-GFCCVEGCSA-N	2	0	303.903	2.921	10	0		DFAERP
CC[NH+](CC)C[C@H]1CCCC[C@H]1NC(=O)C[C@@H]1CCC[C@H]1[NH3+]	ZINC000261875883	284729352	/nfs/dbraw/zinc/72/93/52/284729352.db2.gz	YMJLXSWKJZDYGY-YLFCFFPRSA-N	2	0	309.498	2.521	10	0		DFAERP
Cc1c(F)cccc1NC(=O)C[NH2+]CCCC[NH+]1CCCC1	ZINC000065380594	184331868	/nfs/dbraw/zinc/33/18/68/184331868.db2.gz	PJYVSMZIDZEXFH-UHFFFAOYSA-N	2	0	307.413	2.538	10	0		DFAERP
CCOc1c(CN2CC[C@H]([NH3+])C(C)(C)C2)c(C)nn1CC(C)C	ZINC000261609230	146245820	/nfs/dbraw/zinc/24/58/20/146245820.db2.gz	BSSMEPYHYLSPOZ-INIZCTEOSA-N	2	0	322.497	2.805	10	0		DFAERP
C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1CC[C@@H]([NH3+])C(C)(C)C1	ZINC000261863882	146290956	/nfs/dbraw/zinc/29/09/56/146290956.db2.gz	SLHOTOKWCAGUOL-SMDDNHRTSA-N	2	0	309.841	2.726	10	0		DFAERP
CSc1ccccc1NC(=O)CC[N@@H+]1CC[C@H]([NH3+])C(C)(C)C1	ZINC000261922629	146302779	/nfs/dbraw/zinc/30/27/79/146302779.db2.gz	YVMXQHVOROBHNY-HNNXBMFYSA-N	2	0	321.490	2.796	10	0		DFAERP
C[N@H+](CCO)CCNc1cc(-c2ccccc2)[nH+]c2ccccc12	ZINC000584602925	337371108	/nfs/dbraw/zinc/37/11/08/337371108.db2.gz	DHYKSDQJMKYPBU-UHFFFAOYSA-N	2	0	321.424	2.660	10	0		DFAERP
CC[NH+]1CCN([C@H](C[NH3+])c2cccc(Cl)c2Cl)CC1	ZINC000019861965	182158101	/nfs/dbraw/zinc/15/81/01/182158101.db2.gz	WBFWDLPGQOLRFL-CYBMUJFWSA-N	2	0	302.249	2.631	10	0		DFAERP
CC[C@@H]([NH3+])[C@@H](c1ccc(Cl)s1)N1CC[C@H]([NH+](C)C)C1	ZINC000062963992	184262756	/nfs/dbraw/zinc/26/27/56/184262756.db2.gz	LLHCPGDLPUOFEB-WDMOLILDSA-N	2	0	301.887	2.816	10	0		DFAERP
C[C@@H](c1nc(Cc2ccc(F)cc2)no1)N1CC[C@](C)(C[NH3+])C1	ZINC000261603127	146243794	/nfs/dbraw/zinc/24/37/94/146243794.db2.gz	ADYBTDBXUUGBDE-YVEFUNNKSA-N	2	0	318.396	2.531	10	0		DFAERP
C[C@@H](NC(=O)CN1CC[C@H]([NH3+])C(C)(C)C1)c1ccc(Cl)cc1	ZINC000261605037	146245198	/nfs/dbraw/zinc/24/51/98/146245198.db2.gz	AZILONPMWSALIH-DOMZBBRYSA-N	2	0	323.868	2.576	10	0		DFAERP
C[C@@H]1CCc2nc(C[N@@H+]3CCC4(C3)CC[NH2+]CC4)sc2C1	ZINC000261677355	146257731	/nfs/dbraw/zinc/25/77/31/146257731.db2.gz	AAZOLMMXLJZCCQ-CYBMUJFWSA-N	2	0	305.491	2.843	10	0		DFAERP
C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1CC[C@H]([NH3+])C(C)(C)C1	ZINC000261863874	146290968	/nfs/dbraw/zinc/29/09/68/146290968.db2.gz	SLHOTOKWCAGUOL-FZMZJTMJSA-N	2	0	309.841	2.726	10	0		DFAERP
CC[NH+](CC)[C@H](C(=O)N1CC[C@@H]([NH3+])C(C)(C)C1)c1ccccc1	ZINC000262066365	535664744	/nfs/dbraw/zinc/66/47/44/535664744.db2.gz	SCLJMXGMNXELJB-SJORKVTESA-N	2	0	317.477	2.655	10	0		DFAERP
Cc1nc(C[NH+]2CC[C@@H]3CO[C@H](C[N@@H+](C)C(C)C)[C@H]3C2)cs1	ZINC000503720318	257207195	/nfs/dbraw/zinc/20/71/95/257207195.db2.gz	SBUFHSUMCABGFK-HYVNUMGLSA-N	2	0	323.506	2.629	10	0		DFAERP
CC(C)c1noc([C@@]23CCC[C@@H]2C[N@H+](CC2CC[NH2+]CC2)C3)n1	ZINC000261638362	146250528	/nfs/dbraw/zinc/25/05/28/146250528.db2.gz	DBBWIKNUTQHGLB-CRAIPNDOSA-N	2	0	318.465	2.546	10	0		DFAERP
Cc1cc(NC2CC[NH2+]CC2)nc(N2CCc3ccccc3C2)[nH+]1	ZINC000045947508	274718645	/nfs/dbraw/zinc/71/86/45/274718645.db2.gz	QHVIGGUNIDRCKB-UHFFFAOYSA-N	2	0	323.444	2.512	10	0		DFAERP
Cn1c2ccc(Cl)cc2nc1CN1CC[C@@H]([NH3+])C(C)(C)C1	ZINC000261611070	146246758	/nfs/dbraw/zinc/24/67/58/146246758.db2.gz	CAMAPDMPMRDNIJ-CQSZACIVSA-N	2	0	306.841	2.786	10	0		DFAERP
Cc1ccn2c(C[N@@H+]3C[C@@H](C[NH3+])[C@H](c4ccccc4)C3)cnc2c1	ZINC000261639454	146250752	/nfs/dbraw/zinc/25/07/52/146250752.db2.gz	GFVUHMLDMXBQQV-MJGOQNOKSA-N	2	0	320.440	2.817	10	0		DFAERP
Cc1ccc(NC(=O)CN2CC[C@@H]([NH3+])C(C)(C)C2)cc1Cl	ZINC000261785946	146276315	/nfs/dbraw/zinc/27/63/15/146276315.db2.gz	XJOAQCAAGLUMHN-CQSZACIVSA-N	2	0	309.841	2.646	10	0		DFAERP
CC(C)c1noc([C@@]23CCC[C@@H]2C[N@H+](C[C@@]2(C)CC[NH2+]C2)C3)n1	ZINC000261961666	146310043	/nfs/dbraw/zinc/31/00/43/146310043.db2.gz	HHWZFLYHYQOWNB-FHLIZLRMSA-N	2	0	318.465	2.546	10	0		DFAERP
C[C@@H]1CCC[C@](CNC(=O)C[C@H]2CCCC[C@@H]2[NH3+])([NH+](C)C)C1	ZINC000262521145	146366901	/nfs/dbraw/zinc/36/69/01/146366901.db2.gz	OCFNXRBVPPGPBV-CBZIJGRNSA-N	2	0	309.498	2.521	10	0		DFAERP
Cc1cc(C[N@H+]2CC[C@@H](C3CC[NH+](CC(C)C)CC3)C2)[nH]n1	ZINC000012433434	425727214	/nfs/dbraw/zinc/72/72/14/425727214.db2.gz	JAVMXIGHATZJIV-QGZVFWFLSA-N	2	0	304.482	2.908	10	0		DFAERP
COc1ccccc1C1(F)CC[NH+](CC2CC[NH2+]CC2)CC1	ZINC000261906299	278047351	/nfs/dbraw/zinc/04/73/51/278047351.db2.gz	ZEBHEPKAFPSHPP-UHFFFAOYSA-N	2	0	306.425	2.955	10	0		DFAERP
CC[NH+](CC)CCCn1c2cc(Cl)ccc2nc1CC[NH3+]	ZINC000040403959	183061416	/nfs/dbraw/zinc/06/14/16/183061416.db2.gz	QFNAHVGMPDONBA-UHFFFAOYSA-N	2	0	308.857	2.923	10	0		DFAERP
CC[C@H]([NH3+])[C@@H](c1ccc(Cl)s1)N1CC[C@H]([NH+](C)C)C1	ZINC000062963991	184263144	/nfs/dbraw/zinc/26/31/44/184263144.db2.gz	LLHCPGDLPUOFEB-MJVIPROJSA-N	2	0	301.887	2.816	10	0		DFAERP
C[C@@H](c1nc(Cc2ccc(F)cc2)no1)N1CC[C@@](C)(C[NH3+])C1	ZINC000261603125	146243710	/nfs/dbraw/zinc/24/37/10/146243710.db2.gz	ADYBTDBXUUGBDE-SJCJKPOMSA-N	2	0	318.396	2.531	10	0		DFAERP
CC1(C)C[N@H+](CCC(=O)Nc2ccccc2Cl)CC[C@H]1[NH3+]	ZINC000261702219	146262598	/nfs/dbraw/zinc/26/25/98/146262598.db2.gz	OGXWGCWSTVWLFV-CQSZACIVSA-N	2	0	309.841	2.728	10	0		DFAERP
C[C@H](C(=O)Nc1ccc(Cl)cc1)N1CC[C@@H]([NH3+])C(C)(C)C1	ZINC000261863871	146290862	/nfs/dbraw/zinc/29/08/62/146290862.db2.gz	SLHOTOKWCAGUOL-BXUZGUMPSA-N	2	0	309.841	2.726	10	0		DFAERP
COc1cc(CN2CC[C@@H]([NH3+])C(C)(C)C2)c(SC)cc1OC	ZINC000261867029	146292193	/nfs/dbraw/zinc/29/21/93/146292193.db2.gz	SPJSZYZDXKEMOR-MRXNPFEDSA-N	2	0	324.490	2.985	10	0		DFAERP
CSc1ccccc1NC(=O)CC[N@@H+]1CC[C@@H]([NH3+])C(C)(C)C1	ZINC000261922631	146302791	/nfs/dbraw/zinc/30/27/91/146302791.db2.gz	YVMXQHVOROBHNY-OAHLLOKOSA-N	2	0	321.490	2.796	10	0		DFAERP
c1nc(-c2ccccn2)sc1C[N@@H+]1CCC2(C1)CC[NH2+]CC2	ZINC000261999293	146319680	/nfs/dbraw/zinc/31/96/80/146319680.db2.gz	LDCMMORZASFPPZ-UHFFFAOYSA-N	2	0	314.458	2.781	10	0		DFAERP
CC[NH+](CC)CCN(C)C1CC[NH+](CCc2ccccc2)CC1	ZINC000019636425	182134247	/nfs/dbraw/zinc/13/42/47/182134247.db2.gz	DJFBMRZEIQDHLX-UHFFFAOYSA-N	2	0	317.521	2.967	10	0		DFAERP
CC(C)c1noc([C@@]23CCC[C@@H]2C[N@H+](C[C@@H]2CCC[NH2+]C2)C3)n1	ZINC000261614772	146246658	/nfs/dbraw/zinc/24/66/58/146246658.db2.gz	BFAHZABJYMCHCB-IIDMSEBBSA-N	2	0	318.465	2.546	10	0		DFAERP
Cn1c2ccc(Cl)cc2nc1CN1CC[C@H]([NH3+])C(C)(C)C1	ZINC000261611063	146247202	/nfs/dbraw/zinc/24/72/02/146247202.db2.gz	CAMAPDMPMRDNIJ-AWEZNQCLSA-N	2	0	306.841	2.786	10	0		DFAERP
Cc1ccc(NC(=O)[C@H](C)N2CC[C@H]([NH3+])C(C)(C)C2)cc1F	ZINC000261667245	146256615	/nfs/dbraw/zinc/25/66/15/146256615.db2.gz	ISTRZSOAGRNMBM-WFASDCNBSA-N	2	0	307.413	2.520	10	0		DFAERP
Cc1c(F)cccc1NC(=O)CC[N@@H+]1CC[C@@H]([NH3+])C(C)(C)C1	ZINC000261758115	146272545	/nfs/dbraw/zinc/27/25/45/146272545.db2.gz	LPONZOLXFBNKCB-OAHLLOKOSA-N	2	0	307.413	2.522	10	0		DFAERP
CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1	ZINC000333640856	271381782	/nfs/dbraw/zinc/38/17/82/271381782.db2.gz	XGVFRAJPTMOYJF-FVQBIDKESA-N	2	0	319.497	2.822	10	0		DFAERP
CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1	ZINC000333640859	271382221	/nfs/dbraw/zinc/38/22/21/271382221.db2.gz	XGVFRAJPTMOYJF-KBMXLJTQSA-N	2	0	319.497	2.822	10	0		DFAERP
CC(C)C(=O)Nc1cccc(C2CC[NH+](CCC[NH3+])CC2)c1	ZINC000138626161	398878980	/nfs/dbraw/zinc/87/89/80/398878980.db2.gz	NEXZNIYTIFLZDY-UHFFFAOYSA-N	2	0	303.450	2.809	10	0		DFAERP
C[NH+](C)CC1CCN([C@@H](C[NH3+])c2ccc(Cl)s2)CC1	ZINC000042391903	183263576	/nfs/dbraw/zinc/26/35/76/183263576.db2.gz	DRHXKOXOTMPSEL-LBPRGKRZSA-N	2	0	301.887	2.675	10	0		DFAERP
Cc1ccc(NC(=O)[C@@H](C)N2CC[C@@H]([NH3+])C(C)(C)C2)c(C)c1	ZINC000261667416	146256726	/nfs/dbraw/zinc/25/67/26/146256726.db2.gz	IVFRSSUMMCWLSC-GDBMZVCRSA-N	2	0	303.450	2.690	10	0		DFAERP
COc1ccc(/C=C/CN2C[C@H]3CC[C@@H](C2)[C@H]3[NH+](C)C)cc1	ZINC000102681099	425924854	/nfs/dbraw/zinc/92/48/54/425924854.db2.gz	PHKCDSFWNIQMFL-GMRNKCLUSA-N	2	0	300.446	2.980	10	0		DFAERP
C[C@@H](C[NH+](C)C)n1c2ccccc2nc1CC[NH+]1CCCC1	ZINC000002017848	425589288	/nfs/dbraw/zinc/58/92/88/425589288.db2.gz	MPLFXTFWVDXPQC-HNNXBMFYSA-N	2	0	300.450	2.797	10	0		DFAERP
CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1	ZINC000333541683	271377922	/nfs/dbraw/zinc/37/79/22/271377922.db2.gz	IAPNCIUGQBPFST-GZBFAFLISA-N	2	0	305.470	2.576	10	0		DFAERP
CCCCCCCCCCCC[NH2+]CCNCCNCC[NH3+]	ZINC000138304669	398877553	/nfs/dbraw/zinc/87/75/53/398877553.db2.gz	DWZJYSSNBXBMLS-UHFFFAOYSA-N	2	0	314.562	2.635	10	0		DFAERP
[NH3+]CC[C@H](c1ccccc1)N1CC[NH+](Cc2ccccc2)CC1	ZINC000019936410	182166940	/nfs/dbraw/zinc/16/69/40/182166940.db2.gz	FMYWSOLZOLVVKE-HXUWFJFHSA-N	2	0	309.457	2.894	10	0		DFAERP
[NH3+]C[C@H](c1c(F)cccc1Cl)N1CC[NH+](CC2CC2)CC1	ZINC000020179731	182194616	/nfs/dbraw/zinc/19/46/16/182194616.db2.gz	SPHJBZHNHODIBU-OAHLLOKOSA-N	2	0	311.832	2.507	10	0		DFAERP
CN(CCC[NH+](C)C)[C@H]1CCC[N@H+](CCCc2ccccc2)C1	ZINC000020919677	182253664	/nfs/dbraw/zinc/25/36/64/182253664.db2.gz	IWUDLLLXTYXDOV-FQEVSTJZSA-N	2	0	317.521	2.967	10	0		DFAERP
CC[NH+]1CCC(N(C)[C@H](C[NH3+])c2ccc(Cl)s2)CC1	ZINC000042615573	183291527	/nfs/dbraw/zinc/29/15/27/183291527.db2.gz	HWCOLJQLMVFDCK-GFCCVEGCSA-N	2	0	301.887	2.817	10	0		DFAERP
[NH3+]C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12	ZINC000261548161	146239583	/nfs/dbraw/zinc/23/95/83/146239583.db2.gz	NFBCHLNNXHECSR-MFKWGIFDSA-N	3	0	313.489	2.614	10	0		DFAERP
C[NH+](C)CCn1cccc1[C@H]([NH3+])c1ccc(Br)cc1	ZINC000011848792	425713167	/nfs/dbraw/zinc/71/31/67/425713167.db2.gz	DNSCGJFCTRMXEA-OAHLLOKOSA-N	2	0	322.250	2.860	10	0		DFAERP
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1	ZINC000333640849	271382182	/nfs/dbraw/zinc/38/21/82/271382182.db2.gz	XGVFRAJPTMOYJF-BMFZPTHFSA-N	2	0	319.497	2.822	10	0		DFAERP
CC[NH+](CC)[C@H](C(=O)N1CC[C@H]([NH3+])C(C)(C)C1)c1ccccc1	ZINC000262066363	535666088	/nfs/dbraw/zinc/66/60/88/535666088.db2.gz	SCLJMXGMNXELJB-IRXDYDNUSA-N	2	0	317.477	2.655	10	0		DFAERP
CCc1cccc(NC(=O)C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)c1	ZINC000261767117	535898421	/nfs/dbraw/zinc/89/84/21/535898421.db2.gz	QNIMWNJWGQLXCH-GOSISDBHSA-N	2	0	315.461	2.652	10	0		DFAERP
CCC[C@@H]([NH3+])C(=O)Nc1ccc(OCC[NH+]2CCCCC2)cc1	ZINC000182576139	283451528	/nfs/dbraw/zinc/45/15/28/283451528.db2.gz	UVURDPDLVXOMOL-QGZVFWFLSA-N	2	0	319.449	2.617	10	0		DFAERP
CC[NH+]1CCN([C@@H](C[NH3+])c2cccc(Cl)c2Cl)CC1	ZINC000019861962	182158082	/nfs/dbraw/zinc/15/80/82/182158082.db2.gz	WBFWDLPGQOLRFL-ZDUSSCGKSA-N	2	0	302.249	2.631	10	0		DFAERP
CC[NH+]1CCN([C@@H](C[NH3+])c2ccc(Cl)cc2Cl)CC1	ZINC000019861930	182158167	/nfs/dbraw/zinc/15/81/67/182158167.db2.gz	UGGSRZVOWMLODJ-AWEZNQCLSA-N	2	0	302.249	2.631	10	0		DFAERP
C[C@H](c1nc(Cc2ccc(F)cc2)no1)N1CC[C@@](C)(C[NH3+])C1	ZINC000261603124	146244342	/nfs/dbraw/zinc/24/43/42/146244342.db2.gz	ADYBTDBXUUGBDE-PXAZEXFGSA-N	2	0	318.396	2.531	10	0		DFAERP
CC1(C)CN(Cc2c[nH]nc2-c2ccccc2F)CC[C@@H]1[NH3+]	ZINC000261900622	146298021	/nfs/dbraw/zinc/29/80/21/146298021.db2.gz	WMFRTMCYTGSQIE-HNNXBMFYSA-N	2	0	302.397	2.775	10	0		DFAERP
C[C@@H]1CCC[C@](CNC(=O)C[C@H]2CCCC[C@H]2[NH3+])([NH+](C)C)C1	ZINC000262521161	146366385	/nfs/dbraw/zinc/36/63/85/146366385.db2.gz	OCFNXRBVPPGPBV-KONPQCLYSA-N	2	0	309.498	2.521	10	0		DFAERP
Cc1cc(C[N@H+]2CC[C@H](C3CC[NH+](CC(C)C)CC3)C2)[nH]n1	ZINC000012433435	425727698	/nfs/dbraw/zinc/72/76/98/425727698.db2.gz	JAVMXIGHATZJIV-KRWDZBQOSA-N	2	0	304.482	2.908	10	0		DFAERP
CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]Cc1nnc(C2CC[NH2+]CC2)[nH]1	ZINC000333541679	271378111	/nfs/dbraw/zinc/37/81/11/271378111.db2.gz	IAPNCIUGQBPFST-GUTXKFCHSA-N	2	0	305.470	2.576	10	0		DFAERP
[NH3+]CCC[C@H]([NH3+])c1ccc(Br)c(Br)c1	ZINC000575438592	430084341	/nfs/dbraw/zinc/08/43/41/430084341.db2.gz	MEFZLTRJGFPJNT-JTQLQIEISA-N	2	0	322.044	2.950	10	0		DFAERP
CC[NH+](CC)C[C@@H]1CCCC[C@@H]1NC(=O)C[C@@H]1CCC[C@H]1[NH3+]	ZINC000261875880	279120558	/nfs/dbraw/zinc/12/05/58/279120558.db2.gz	YMJLXSWKJZDYGY-NXOAAHMSSA-N	2	0	309.498	2.521	10	0		DFAERP
COc1cc2[nH+]c(NCCC[NH+](C)C)cc(C)c2c(OC)c1	ZINC000016671061	182056566	/nfs/dbraw/zinc/05/65/66/182056566.db2.gz	KJJXIMPRODKPFY-UHFFFAOYSA-N	2	0	303.406	2.924	10	0		DFAERP
CN(CC[NH+](C)C)[C@H]1CCC[N@H+](CCCc2ccccc2)C1	ZINC000019771209	182145535	/nfs/dbraw/zinc/14/55/35/182145535.db2.gz	MFELLWVUFSFTBC-IBGZPJMESA-N	2	0	303.494	2.577	10	0		DFAERP
C[N@@H+]1CCCN([C@@H](C[NH3+])c2cccc(Cl)c2Cl)CC1	ZINC000021513703	182276288	/nfs/dbraw/zinc/27/62/88/182276288.db2.gz	DVUDFZJVLLLWLG-ZDUSSCGKSA-N	2	0	302.249	2.631	10	0		DFAERP
Cc1cccc(C[NH+]2CC[C@H]3[C@H](C[N@@H+](C)C(C)C)OC[C@@H]3C2)n1	ZINC000503717729	257208898	/nfs/dbraw/zinc/20/88/98/257208898.db2.gz	AGQIIPAFGUAVFK-UHOSZYNNSA-N	2	0	317.477	2.567	10	0		DFAERP
C[C@H]1CCc2nc(C[N@@H+]3CCC4(C3)CC[NH2+]CC4)sc2C1	ZINC000261677358	146257774	/nfs/dbraw/zinc/25/77/74/146257774.db2.gz	AAZOLMMXLJZCCQ-ZDUSSCGKSA-N	2	0	305.491	2.843	10	0		DFAERP
CC1(C)CN(Cc2cnc(-c3ccccn3)s2)CC[C@H]1[NH3+]	ZINC000261678478	146258476	/nfs/dbraw/zinc/25/84/76/146258476.db2.gz	JVBPEQBBTSJNKZ-CQSZACIVSA-N	2	0	302.447	2.764	10	0		DFAERP
Cc1ccc(C[N@@H+]2CC[C@@H]([NH3+])C(C)(C)C2)c(-c2ccnn2C)c1	ZINC000261961092	146310036	/nfs/dbraw/zinc/31/00/36/146310036.db2.gz	PFYKQHPALVAJSL-GOSISDBHSA-N	2	0	312.461	2.955	10	0		DFAERP
CC(C)[NH2+]C[C@H]1CCN(C2CC[NH+](Cc3ccccc3)CC2)C1	ZINC000076530579	185020087	/nfs/dbraw/zinc/02/00/87/185020087.db2.gz	JXJCNUFOAPQOGM-LJQANCHMSA-N	2	0	315.505	2.971	10	0		DFAERP
CC[NH+]1CCC(N(C)[C@@H](C[NH3+])c2ccc(Cl)s2)CC1	ZINC000042615572	183291419	/nfs/dbraw/zinc/29/14/19/183291419.db2.gz	HWCOLJQLMVFDCK-LBPRGKRZSA-N	2	0	301.887	2.817	10	0		DFAERP
CC(C)CN(CC[NH+](C)C)[C@@H](C[NH3+])c1ccc(Cl)s1	ZINC000042744403	183304991	/nfs/dbraw/zinc/30/49/91/183304991.db2.gz	WIKDLDJLRBVASE-LBPRGKRZSA-N	2	0	303.903	2.921	10	0		DFAERP
C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)c(Br)c1	ZINC000061699554	184183788	/nfs/dbraw/zinc/18/37/88/184183788.db2.gz	KDRRUXBZQBJCNV-SNVBAGLBSA-N	2	0	301.228	2.670	10	0		DFAERP
Cc1nc(C[NH+]2CC[C@@H]3CO[C@H](C[N@@H+](C)C(C)C)[C@@H]3C2)cs1	ZINC000503720317	257207110	/nfs/dbraw/zinc/20/71/10/257207110.db2.gz	SBUFHSUMCABGFK-DJIMGWMZSA-N	2	0	323.506	2.629	10	0		DFAERP
CC1(C)CN(Cc2ccc(OC[C@@H]3CCCO3)cc2)CC[C@H]1[NH3+]	ZINC000261605070	146245135	/nfs/dbraw/zinc/24/51/35/146245135.db2.gz	BAPRJWMNJKBNBN-ZWKOTPCHSA-N	2	0	318.461	2.804	10	0		DFAERP
CCCOc1ccc(OCC[N@@H+]2CC[C@H]([NH3+])C(C)(C)C2)cc1	ZINC000262493774	146364609	/nfs/dbraw/zinc/36/46/09/146364609.db2.gz	LEQRPRZXURFUQR-KRWDZBQOSA-N	2	0	306.450	2.913	10	0		DFAERP
COc1ccccc1C1(F)CC[NH+](C[C@H]2CCC[NH2+]C2)CC1	ZINC000261871779	278047628	/nfs/dbraw/zinc/04/76/28/278047628.db2.gz	VJBSXAMUJPGKJP-HNNXBMFYSA-N	2	0	306.425	2.955	10	0		DFAERP
CC[NH+](CC)CCOc1ccc(Br)cc1C[NH2+]C	ZINC000019777176	182147513	/nfs/dbraw/zinc/14/75/13/182147513.db2.gz	ITZCSRIKDPCNJO-UHFFFAOYSA-N	2	0	315.255	2.889	10	0		DFAERP
CCC[NH2+]Cc1ccc(OCC[NH+](C)C)c(Br)c1	ZINC000062701608	184247905	/nfs/dbraw/zinc/24/79/05/184247905.db2.gz	WPTKXEWMVBYIJK-UHFFFAOYSA-N	2	0	315.255	2.889	10	0		DFAERP
CC[NH2+]CCC[NH2+]CCCCCCCC[NH2+]CCC[NH2+]CC	ZINC000003790051	181045810	/nfs/dbraw/zinc/04/58/10/181045810.db2.gz	GFBIZPHYEIUDRZ-UHFFFAOYSA-N	4	0	314.562	2.505	10	0		DFAERP
[NH3+]CC[C@@H](c1ccccc1)N1CC[NH+](Cc2ccccc2)CC1	ZINC000019936413	182167203	/nfs/dbraw/zinc/16/72/03/182167203.db2.gz	FMYWSOLZOLVVKE-FQEVSTJZSA-N	2	0	309.457	2.894	10	0		DFAERP
CC[NH+](CC)CCn1c2ccc(Cl)cc2nc1CCC[NH3+]	ZINC000040405777	183062121	/nfs/dbraw/zinc/06/21/21/183062121.db2.gz	IFVXRNDYKXOQGU-UHFFFAOYSA-N	2	0	308.857	2.923	10	0		DFAERP
C[N@H+](Cc1ccc(Br)cc1)Cc1cccnc1C[NH3+]	ZINC000061656669	184181259	/nfs/dbraw/zinc/18/12/59/184181259.db2.gz	XJDRTEVFKIXUGS-UHFFFAOYSA-N	2	0	320.234	2.935	10	0		DFAERP
Cc1ccc(C[N@@H+]2CC[C@H]([NH3+])C(C)(C)C2)c(-c2ccnn2C)c1	ZINC000261961093	146309833	/nfs/dbraw/zinc/30/98/33/146309833.db2.gz	PFYKQHPALVAJSL-SFHVURJKSA-N	2	0	312.461	2.955	10	0		DFAERP
C[C@@H]1CCC[C@](CNC(=O)C[C@@H]2CCCC[C@H]2[NH3+])([NH+](C)C)C1	ZINC000262521156	146367061	/nfs/dbraw/zinc/36/70/61/146367061.db2.gz	OCFNXRBVPPGPBV-HPFXQQBRSA-N	2	0	309.498	2.521	10	0		DFAERP
C[NH2+]CC1(O)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(F)cc(Cl)c1	ZINC000033358710	425842018	/nfs/dbraw/zinc/84/20/18/425842018.db2.gz	BKKAPFQCJDVXQI-XYPWUTKMSA-N	2	0	312.816	2.556	10	0		DFAERP