smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CSc1nc2c(ncn2[C@@H]2OC[C@H](O)[C@@H](O)[C@@H]2O)c(=O)[n-]1	ZINC000017191042	182079426	/nfs/dbraw/zinc/07/94/26/182079426.db2.gz	GBYNCABPYXTMHP-PERBPWGJSA-N	-1	1	314.323	-1.547	1	0		DAAFMM
Nc1nc(=O)c2c([nH]1)N(CCOC[P@](=O)([O-])O)[C@H](O)N2	ZINC000043066905	183333649	/nfs/dbraw/zinc/33/36/49/183333649.db2.gz	MOLZRVKUJFFFAQ-MRVPVSSYSA-N	-1	1	307.203	-1.988	1	0		DAAFMM
C[C@@H](CN1NNc2c1nc(N)[nH]c2=O)OC[P@](=O)([O-])O	ZINC000043078437	183335098	/nfs/dbraw/zinc/33/50/98/183335098.db2.gz	QUUFIELQBMFQPQ-BYPYZUCNSA-N	-1	1	306.219	-1.456	1	0		DAAFMM
Cc1cn(Cc2cn(C[P@](=O)([O-])O)nn2)c(=O)[nH]c1=O	ZINC000064539463	184299205	/nfs/dbraw/zinc/29/92/05/184299205.db2.gz	WKAWQDMTZJWWSM-UHFFFAOYSA-N	-1	1	301.199	-1.380	1	0		DAAFMM
[NH2+]=C(CNC=O)N[C@H]1O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]1O	ZINC000013532131	560218780	/nfs/dbraw/zinc/21/87/80/560218780.db2.gz	PMCOGCVKOAOZQM-JBBNEOJLSA-N	-1	1	313.203	-3.145	1	0	in-vitro,metabolite	DAAFMM
CC(C)C[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CN)C(=O)[O-]	ZINC000039818922	571754943	/nfs/dbraw/zinc/75/49/43/571754943.db2.gz	JVWPPCWUDRJGAE-JGVFFNPUSA-N	-1	1	302.331	-1.029	1	0	endogenous,in-man	DAAFMM
O=c1[n-]c2c([nH]1)n([C@@H]1O[C@H](CO)[C@H](O)[C@@H]1O)c(=O)[nH]c2=O	ZINC000085837712	574416786	/nfs/dbraw/zinc/41/67/86/574416786.db2.gz	MFGPUMDDJCTHOI-VCAJRUBLSA-N	-1	1	300.227	-2.858	1	0	endogenous,in-man	DAAFMM
C[C@H](NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)OCC(=O)[O-]	ZINC000095563221	185379920	/nfs/dbraw/zinc/37/99/20/185379920.db2.gz	WRFUUTYZFIHNDN-YUMQZZPRSA-N	-1	1	301.299	-1.931	1	0		DAAFMM
O=c1ccn([C@@H]2O[C@H](C=C[P@](=O)([O-])O)[C@@H](O)[C@H]2F)c(=O)[nH]1	ZINC000096927008	185392124	/nfs/dbraw/zinc/39/21/24/185392124.db2.gz	MFJSMSUFJROBMZ-LNFZUNPYSA-N	-1	1	322.185	-1.176	1	0		DAAFMM
O=c1[nH]cnc2c1ncn2CCO[C@H](CO)C[P@](=O)([O-])O	ZINC000072175643	191071267	/nfs/dbraw/zinc/07/12/67/191071267.db2.gz	NQACUYLBHCGRGS-SSDOTTSWSA-N	-1	1	318.226	-1.325	1	0		DAAFMM
Nc1ccn([C@H]2C=C[C@@H]([P@](=O)([O-])O)O[C@H]2CO)c(=O)n1	ZINC000003626375	181042249	/nfs/dbraw/zinc/04/22/49/181042249.db2.gz	RIMWJMIMBQFXCD-ACLDMZEESA-N	-1	1	303.211	-1.182	1	0		DAAFMM
Nc1nc2c(nnn2C[C@@H](CO)OC[P@](=O)([O-])O)c(N)n1	ZINC000003636957	181042716	/nfs/dbraw/zinc/04/27/16/181042716.db2.gz	VXDBQGLWQMDPCQ-BYPYZUCNSA-N	-1	1	319.218	-2.102	1	0		DAAFMM
CCC[C@H](NC(=O)[C@H](N)CNC(=O)/C=C/C(=O)OC)C(=O)[O-]	ZINC000006380862	181335883	/nfs/dbraw/zinc/33/58/83/181335883.db2.gz	KQMMELKFURFKHE-RKWMXMRGSA-N	-1	1	315.326	-1.471	1	0		DAAFMM
Nc1nc(N)c(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)c(=O)[n-]1	ZINC000257463037	203068644	/nfs/dbraw/zinc/06/86/44/203068644.db2.gz	KGNGTSCIQCLKEH-PTOWMRSTSA-N	-1	1	304.259	-3.475	1	0	endogenous,in-man	DAAFMM
C[NH+](C)C[C@@H](Cn1ccc(N)nc1=O)OCP(=O)([O-])[O-]	ZINC000040475237	183074361	/nfs/dbraw/zinc/07/43/61/183074361.db2.gz	JBOOYKIWLXTTBA-QMMMGPOBSA-N	-1	1	306.259	-1.093	1	0		DAAFMM
Nc1nc(=O)c2c([nH]1)N(C[C@@H](CO)OC[P@](=O)([O-])O)CN2	ZINC000042921631	183318015	/nfs/dbraw/zinc/31/80/15/183318015.db2.gz	SPLAHEWQICOEBR-YFKPBYRVSA-N	-1	1	321.230	-1.946	1	0		DAAFMM
Nc1nc(=O)c2c([nH]1)N(C[C@H](CO)OC[P@](=O)([O-])O)CN2	ZINC000042921633	183318378	/nfs/dbraw/zinc/31/83/78/183318378.db2.gz	SPLAHEWQICOEBR-RXMQYKEDSA-N	-1	1	321.230	-1.946	1	0		DAAFMM
O=C(CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccc([O-])cc1	ZINC000085648537	560067002	/nfs/dbraw/zinc/06/70/02/560067002.db2.gz	ITSGGSZQQLOKQY-RKQHYHRCSA-N	-1	1	314.290	-1.609	1	0	biogenic,in-vitro	DAAFMM
COC(=O)/C=C/C(=O)NC[C@H](N)C(=O)N[C@H](C(=O)[O-])C(C)C	ZINC000005963145	560203966	/nfs/dbraw/zinc/20/39/66/560203966.db2.gz	JRYYPGRGZBRRME-DLUMPMLVSA-N	-1	1	315.326	-1.616	1	0	in-vitro	DAAFMM
O=c1[nH]c2c([nH]c(=O)[n-]c2=O)n1[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O	ZINC000014687099	560224425	/nfs/dbraw/zinc/22/44/25/560224425.db2.gz	XRFDFDQNRIGZOW-WCHFOYDZSA-N	-1	1	300.227	-3.682	1	0	in-vitro	DAAFMM
C[C@H](NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)NCC(=O)[O-]	ZINC000095558191	185379724	/nfs/dbraw/zinc/37/97/24/185379724.db2.gz	PRCWSSALMZBWJM-YUMQZZPRSA-N	-1	1	300.315	-2.358	1	0		DAAFMM
Cc1cn(CCO[C@H](CO)C[P@](=O)([O-])O)c(=O)[nH]c1=O	ZINC000072175987	191071236	/nfs/dbraw/zinc/07/12/36/191071236.db2.gz	URPQCSVSLVBQDB-MRVPVSSYSA-N	-1	1	308.227	-1.600	1	0		DAAFMM
Nc1ncnc2nn(C[C@@H](CO)OC[P@](=O)([O-])O)nc21	ZINC000003636960	181042661	/nfs/dbraw/zinc/04/26/61/181042661.db2.gz	USXXJROTGMHYDG-YFKPBYRVSA-N	-1	1	304.203	-1.684	1	0		DAAFMM
COC(=O)/C=C/C(=O)NC[C@@H](N)C(=O)N[C@H](C(=O)[O-])C(C)C	ZINC000005963143	181301302	/nfs/dbraw/zinc/30/13/02/181301302.db2.gz	JRYYPGRGZBRRME-UGZBIMKRSA-N	-1	1	315.326	-1.616	1	0	in-vitro	DAAFMM
O=c1[n-]c2c([nH]1)n([C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O)c(=O)[nH]c2=O	ZINC000014687097	571719818	/nfs/dbraw/zinc/71/98/18/571719818.db2.gz	MFGPUMDDJCTHOI-UZJDFGQCSA-N	-1	1	300.227	-3.682	1	0	endogenous,in-man	DAAFMM
O=c1[n-]c2c([nH]1)n([C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O)c(=O)[nH]c2=O	ZINC000014687091	571719845	/nfs/dbraw/zinc/71/98/45/571719845.db2.gz	MFGPUMDDJCTHOI-WCHFOYDZSA-N	-1	1	300.227	-3.270	1	0	endogenous,in-man	DAAFMM
O=c1[n-]c2c([nH]1)n([C@@H]1O[C@H](CO)[C@H](O)[C@H]1O)c(=O)[nH]c2=O	ZINC000140682730	571850688	/nfs/dbraw/zinc/85/06/88/571850688.db2.gz	MFGPUMDDJCTHOI-SAFLGMAISA-N	-1	1	300.227	-3.682	1	0	endogenous,in-man	DAAFMM
Cc1cn(CCO[C@@H](CO)C[P@](=O)([O-])O)c(=O)[nH]c1=O	ZINC000072175986	191070780	/nfs/dbraw/zinc/07/07/80/191070780.db2.gz	URPQCSVSLVBQDB-QMMMGPOBSA-N	-1	1	308.227	-1.600	1	0		DAAFMM
Nc1nc2nn(C[C@@H](CF)OC[P@](=O)([O-])O)nc2c(N)n1	ZINC000003636935	181042653	/nfs/dbraw/zinc/04/26/53/181042653.db2.gz	HRIDRTKXFONPOM-SCSAIBSYSA-N	-1	1	321.209	-1.124	1	0		DAAFMM
Nc1ncnc2c1ncn2O[C@H](/C=C/[P@](=O)([O-])O)CO	ZINC000005941403	181299286	/nfs/dbraw/zinc/29/92/86/181299286.db2.gz	IDOLXIZHUZCUIL-UGQQDIOTSA-N	-1	1	301.199	-1.111	1	0		DAAFMM
C[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)[O-]	ZINC000006020092	181305999	/nfs/dbraw/zinc/30/59/99/181305999.db2.gz	DLZKEQQWXODGGZ-KWQFWETISA-N	-1	1	309.322	-1.033	1	0		DAAFMM
CSc1nc(N[C@H]2OC[C@H](O)[C@@H](O)[C@@H]2O)c(N)c(=O)[n-]1	ZINC000016953133	182065540	/nfs/dbraw/zinc/06/55/40/182065540.db2.gz	TZLFZCHHZJNLME-HFXAWCPLSA-N	-1	1	304.328	-2.075	1	0		DAAFMM
CSc1nc(N[C@@H]2OC[C@H](O)[C@@H](O)[C@@H]2O)c(N)c(=O)[n-]1	ZINC000017191012	182079505	/nfs/dbraw/zinc/07/95/05/182079505.db2.gz	TZLFZCHHZJNLME-FULWYAMNSA-N	-1	1	304.328	-2.075	1	0		DAAFMM
Nc1nc(=O)c2c([nH]1)N(CCOCC[P@](=O)([O-])O)CN2	ZINC000043066641	183333288	/nfs/dbraw/zinc/33/32/88/183333288.db2.gz	FZOXQSGSMTWUDL-UHFFFAOYSA-N	-1	1	305.231	-1.264	1	0		DAAFMM
C[C@@H](NC(=O)[C@@H](C)NC(=O)[C@@H]([NH3+])CC[P@](C)(=O)[O-])C(=O)[O-]	ZINC000011592987	560211321	/nfs/dbraw/zinc/21/13/21/560211321.db2.gz	GINJFDRNADDBIN-PRJMDXOYSA-N	-1	1	323.286	-1.302	1	0	in-vitro	DAAFMM
O=c1[nH]c2c([nH]c(=O)[n-]c2=O)n1[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O	ZINC000014687101	560224475	/nfs/dbraw/zinc/22/44/75/560224475.db2.gz	XRFDFDQNRIGZOW-AJFJRRQVSA-N	-1	1	300.227	-3.682	1	0	in-vitro	DAAFMM
O=c1[n-]c2c([nH]1)n([C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O)c(=O)[nH]c2=O	ZINC000014687093	571719841	/nfs/dbraw/zinc/71/98/41/571719841.db2.gz	MFGPUMDDJCTHOI-AJFJRRQVSA-N	-1	1	300.227	-3.270	1	0	endogenous,in-man	DAAFMM
O=c1[nH]cnc2c1ncn2CCO[C@@H](CO)C[P@](=O)([O-])O	ZINC000072175642	191070523	/nfs/dbraw/zinc/07/05/23/191070523.db2.gz	NQACUYLBHCGRGS-ZETCQYMHSA-N	-1	1	318.226	-1.325	1	0		DAAFMM
C[C@@H](Cn1nc2nc(N)[nH]c(=O)c2n1)OC[P@](=O)([O-])O	ZINC000003626596	181042400	/nfs/dbraw/zinc/04/24/00/181042400.db2.gz	IWBJWGPUBWGCDK-BYPYZUCNSA-N	-1	1	304.203	-1.363	1	0		DAAFMM
Nc1nc2c(nnn2C[C@@H](CF)OC[P@](=O)([O-])O)c(N)n1	ZINC000003636938	181042646	/nfs/dbraw/zinc/04/26/46/181042646.db2.gz	BZVKDXBBAQWXEO-SCSAIBSYSA-N	-1	1	321.209	-1.124	1	0		DAAFMM
C[C@H](Cn1nnc2c1nc(N)nc2N)OC[P@](=O)([O-])O	ZINC000003636951	181042884	/nfs/dbraw/zinc/04/28/84/181042884.db2.gz	DKORZWSWXIJHMK-SCSAIBSYSA-N	-1	1	303.219	-1.074	1	0		DAAFMM
Nc1nc2c(ncn2C[C@@H](O)COC[P@](=O)([O-])O)c(=O)[nH]1	ZINC000073219953	191294537	/nfs/dbraw/zinc/29/45/37/191294537.db2.gz	OGWFSFLFEFQHOH-RXMQYKEDSA-N	-1	1	319.214	-1.786	1	0		DAAFMM
O=c1ccn([C@@H]2O[C@H](OC[P@](=O)([O-])O)[C@@H](O)[C@H]2O)c(=O)[nH]1	ZINC000073293048	191301074	/nfs/dbraw/zinc/30/10/74/191301074.db2.gz	WRHHYDLLFIODTO-CWKFCGSDSA-N	-1	1	324.182	-2.735	1	0		DAAFMM
Nc1nc(N)c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)c(=O)[n-]1	ZINC000004878658	181167073	/nfs/dbraw/zinc/16/70/73/181167073.db2.gz	KGNGTSCIQCLKEH-DSYKXORRSA-N	-1	1	304.259	-3.887	1	0	in-man	DAAFMM
O=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](CC[P@](=O)([O-])O)O2)cc1F	ZINC000017109199	182075927	/nfs/dbraw/zinc/07/59/27/182075927.db2.gz	AVQMCZOTCNTEPR-XLPZGREQSA-N	-1	1	324.201	-1.108	1	0		DAAFMM
O=c1ccn(Cc2cn(CC[P@@](=O)([O-])O)nn2)c(=O)[nH]1	ZINC000064548680	184299305	/nfs/dbraw/zinc/29/93/05/184299305.db2.gz	JLSCEEGATLVACK-UHFFFAOYSA-N	-1	1	301.199	-1.646	1	0		DAAFMM
O=C([O-])[C@H](O)CC[NH2+][C@H](CC[N@H+]1CC[C@H]1C(=O)[O-])C(=O)[O-]	ZINC000071758291	257128022	/nfs/dbraw/zinc/12/80/22/257128022.db2.gz	CUZKLRTTYZOCSD-HRDYMLBCSA-N	-1	1	304.299	-1.586	1	0	endogenous,in-man	DAAFMM
[NH2+]=C(CNC=O)N[C@@H]1O[C@@H](COP(=O)([O-])[O-])[C@@H](O)[C@@H]1O	ZINC000012495781	571694709	/nfs/dbraw/zinc/69/47/09/571694709.db2.gz	PMCOGCVKOAOZQM-VXUIKNBNSA-N	-1	1	313.203	-3.145	1	0	endogenous,in-man	DAAFMM
Nc1nc2c(c(=O)[n-]1)N(O)[C@](O)([C@@H](O)[C@@H](O)CO)[C@@H](O)N2O	ZINC000008551749	574412906	/nfs/dbraw/zinc/41/29/06/574412906.db2.gz	XWORXFNMQCQKKK-XLGRDXQRSA-N	-1	1	321.246	-4.522	1	0	endogenous,in-vitro	DAAFMM
C[C@H](Cn1nnc2c1nc(N)[nH]c2=O)OC[P@](=O)([O-])O	ZINC000003636947	181042848	/nfs/dbraw/zinc/04/28/48/181042848.db2.gz	BZEVAOVZVAWBDP-SCSAIBSYSA-N	-1	1	304.203	-1.363	1	0		DAAFMM
C[C@H](Cn1nc2nc(N)[nH]c(=O)c2n1)OC[P@](=O)([O-])O	ZINC000003636943	181042893	/nfs/dbraw/zinc/04/28/93/181042893.db2.gz	IWBJWGPUBWGCDK-SCSAIBSYSA-N	-1	1	304.203	-1.363	1	0		DAAFMM
Nc1nc2c(sc(=O)n2[C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[n-]1	ZINC000003799787	181046110	/nfs/dbraw/zinc/04/61/10/181046110.db2.gz	BUPFRCZRKDMLQR-VPENINKCSA-N	-1	1	300.296	-1.631	1	0		DAAFMM
C[C@@H](NC(=O)[C@@H]([NH3+])CC[P@](C)(=O)[O-])C(=O)N[C@@H](C)C(=O)[O-]	ZINC000006032491	181306827	/nfs/dbraw/zinc/30/68/27/181306827.db2.gz	GINJFDRNADDBIN-CSMHCCOUSA-N	-1	1	323.286	-1.302	1	0	in-vitro	DAAFMM
Nc1nc(N)c(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)c(=O)[n-]1	ZINC000257463036	203068298	/nfs/dbraw/zinc/06/82/98/203068298.db2.gz	KGNGTSCIQCLKEH-FWKNIVCOSA-N	-1	1	304.259	-3.475	1	0	endogenous,in-man	DAAFMM
O=C([O-])[C@H](O)CC[NH2+][C@@H](CC[N@H+]1CC[C@H]1C(=O)[O-])C(=O)[O-]	ZINC000071758292	304173680	/nfs/dbraw/zinc/17/36/80/304173680.db2.gz	CUZKLRTTYZOCSD-XHNCKOQMSA-N	-1	1	304.299	-1.586	1	0	endogenous,in-man	DAAFMM
CSc1nc2c(ncn2[C@H]2OC[C@H](O)[C@@H](O)[C@@H]2O)c(=O)[n-]1	ZINC000016953141	182065778	/nfs/dbraw/zinc/06/57/78/182065778.db2.gz	GBYNCABPYXTMHP-HUEBKHCJSA-N	-1	1	314.323	-1.547	1	0		DAAFMM
O=c1ccn([C@@H]2O[C@H](CO)[C@@H]([P@](=O)([O-])O)[C@@H]2O)c(=O)[nH]1	ZINC000017260638	182080881	/nfs/dbraw/zinc/08/08/81/182080881.db2.gz	GLFLOZNLDYSPKW-PXBUCIJWSA-N	-1	1	308.183	-2.667	1	0		DAAFMM
C[NH+](C)C[C@H](Cn1ccc(N)nc1=O)OCP(=O)([O-])[O-]	ZINC000040475238	183074417	/nfs/dbraw/zinc/07/44/17/183074417.db2.gz	JBOOYKIWLXTTBA-MRVPVSSYSA-N	-1	1	306.259	-1.093	1	0		DAAFMM
Nc1nc(=O)c2c([nH]1)N(CCOC[P@](=O)([O-])O)[C@@H](O)N2	ZINC000043066901	183333447	/nfs/dbraw/zinc/33/34/47/183333447.db2.gz	MOLZRVKUJFFFAQ-QMMMGPOBSA-N	-1	1	307.203	-1.988	1	0		DAAFMM
[NH2+]=C(CNC=O)N[C@@H]1O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@@H]1O	ZINC000012495791	571694903	/nfs/dbraw/zinc/69/49/03/571694903.db2.gz	PMCOGCVKOAOZQM-CCXZUQQUSA-N	-1	1	313.203	-3.145	1	0	endogenous,in-man	DAAFMM
Nc1nc2c(ncn2C[C@H](O)COC[P@](=O)([O-])O)c(=O)[nH]1	ZINC000073219948	191294434	/nfs/dbraw/zinc/29/44/34/191294434.db2.gz	OGWFSFLFEFQHOH-YFKPBYRVSA-N	-1	1	319.214	-1.786	1	0		DAAFMM
O=C([O-])[C@H](O)CC[NH2+][C@H](CC[N@H+]1CC[C@@H]1C(=O)[O-])C(=O)[O-]	ZINC000014610454	304173806	/nfs/dbraw/zinc/17/38/06/304173806.db2.gz	CUZKLRTTYZOCSD-IWSPIJDZSA-N	-1	1	304.299	-1.586	1	0	endogenous,in-man	DAAFMM
O=C([O-])[C@H](O)CC[NH2+][C@@H](CC[N@H+]1CC[C@@H]1C(=O)[O-])C(=O)[O-]	ZINC000014610450	257133588	/nfs/dbraw/zinc/13/35/88/257133588.db2.gz	CUZKLRTTYZOCSD-DJLDLDEBSA-N	-1	1	304.299	-1.586	1	0	endogenous,in-man	DAAFMM
O=c1[n-]c2c([nH]1)n([C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1O)c(=O)[nH]c2=O	ZINC000014687095	571719806	/nfs/dbraw/zinc/71/98/06/571719806.db2.gz	MFGPUMDDJCTHOI-MITLYWJASA-N	-1	1	300.227	-3.682	1	0	endogenous,in-man	DAAFMM
C[C@@H](Cn1nnc2c1nc(N)[nH]c2=O)OC[P@](=O)([O-])O	ZINC000003636945	181042937	/nfs/dbraw/zinc/04/29/37/181042937.db2.gz	BZEVAOVZVAWBDP-BYPYZUCNSA-N	-1	1	304.203	-1.363	1	0		DAAFMM
Nc1nc2c(ncn2C[C@@H](C[NH3+])OCP(=O)([O-])[O-])c(N)n1	ZINC000003653405	181044207	/nfs/dbraw/zinc/04/42/07/181044207.db2.gz	FENFAHGXUBBCQN-RXMQYKEDSA-N	-1	1	317.246	-1.530	1	0		DAAFMM
Nc1nc2c(ncn2C[C@H](C[NH3+])OCP(=O)([O-])[O-])c(N)n1	ZINC000003653408	181044406	/nfs/dbraw/zinc/04/44/06/181044406.db2.gz	FENFAHGXUBBCQN-YFKPBYRVSA-N	-1	1	317.246	-1.530	1	0		DAAFMM
CC(=O)c1ccc([O-])cc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O	ZINC000005167604	181212613	/nfs/dbraw/zinc/21/26/13/181212613.db2.gz	UEIZKRYEGCOJBJ-RKQHYHRCSA-N	-1	1	314.290	-1.227	1	0	biogenic,in-vitro	DAAFMM
Nc1ncnc2c1ncn2O[C@@H](/C=C/[P@](=O)([O-])O)CO	ZINC000005941413	181299561	/nfs/dbraw/zinc/29/95/61/181299561.db2.gz	IDOLXIZHUZCUIL-IPWVHJGXSA-N	-1	1	301.199	-1.111	1	0		DAAFMM
O=c1ccn([C@@H]2O[C@H](CC[P@](=O)([O-])O)[C@@H](O)[C@H]2O)c(=O)[nH]1	ZINC000040953862	183150742	/nfs/dbraw/zinc/15/07/42/183150742.db2.gz	VCBYDBJSZPKARR-ZOQUXTDFSA-N	-1	1	322.210	-2.276	1	0		DAAFMM
Cc1cn(Cc2cn(CC[P@](=O)([O-])O)nn2)c(=O)[nH]c1=O	ZINC000064548548	184299155	/nfs/dbraw/zinc/29/91/55/184299155.db2.gz	RVUAWCDXXCWXQZ-UHFFFAOYSA-N	-1	1	315.226	-1.337	1	0		DAAFMM
C[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]([NH3+])CC[P@](C)(=O)[O-])C(=O)[O-]	ZINC000011592507	560211344	/nfs/dbraw/zinc/21/13/44/560211344.db2.gz	GINJFDRNADDBIN-RNJXMRFFSA-N	-1	1	323.286	-1.302	1	0	in-vitro	DAAFMM