Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB04672"

Predicate	Value (sorted: none)
drugbank:description	" experimental This compound belongs to the pyrimidine nucleosides and analogues. These are compounds comprising a pyrimidine base attached to a sugar. Pyrimidine Nucleosides and Analogues Organic Compounds Organooxygen Compounds Carbohydrates and Carbohydrate Conjugates Glycosyl Compounds Pyrimidones Organic Phosphoric Acids Organophosphate Esters Hydropyrimidines Dihydrofurans Ethers Polyamines pyrimidone hydropyrimidine organic phosphate pyrimidine phosphoric acid ester dihydrofuran polyamine ether amine organonitrogen compound 2',3'-dehydro-2',3'-deoxy-thymidine 5'-monophosphate 2',3'-dideoxy-2',3-didehydrothymidine 5'-monophosphate 3',5'-Cyclic dtmp cTMP Cyclic tmp D4T-MP d4TMP logP -0.98 ALOGPS logS -1.8 ALOGPS Water Solubility 4.64e+00 g/l ALOGPS logP -0.36 ChemAxon IUPAC Name {[(2S,5R)-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methoxy}phosphonic acid ChemAxon Traditional IUPAC Name [(2S,5R)-5-(5-methyl-2,4-dioxo-3H-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methoxyphosphonic acid ChemAxon Molecular Weight 304.1932 ChemAxon Monoisotopic Weight 304.046037292 ChemAxon SMILES [H][C@]1(COP(O)(O)=O)O[C@]([H])(C=C1)N1C=C(C)C(=O)NC1=O ChemAxon Molecular Formula C10H13N2O7P ChemAxon InChI InChI=1S/C10H13N2O7P/c1-6-4-12(10(14)11-9(6)13)8-3-2-7(19-8)5-18-20(15,16)17/h2-4,7-8H,5H2,1H3,(H,11,13,14)(H2,15,16,17)/t7-,8+/m0/s1 ChemAxon InChIKey InChIKey=XLPGURCDSRIXFL-JGVFFNPUSA-N ChemAxon Polar Surface Area (PSA) 125.4 ChemAxon Refractivity 66.19 ChemAxon Polarizability 25.93 ChemAxon Rotatable Bond Count 4 ChemAxon H Bond Acceptor Count 6 ChemAxon H Bond Donor Count 3 ChemAxon pKa (strongest acidic) 1.24 ChemAxon pKa (strongest basic) -4.2 ChemAxon Physiological Charge -2 ChemAxon Number of Rings 2 ChemAxon Bioavailability 1 ChemAxon Rule of Five true ChemAxon Ghose Filter true ChemAxon PubChem Compound 461278 PubChem Substance 46508608 ChemSpider 405848 PDB D4M BE0001515 5'(3')-deoxyribonucleotidase, mitochondrial Human # Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. "Pubmed":http://www.ncbi.nlm.nih.gov/pubmed/10592235 unknown 5'(3')-deoxyribonucleotidase, mitochondrial Involved in nucleotidase activity Dephosphorylates specifically the 5' and 2'(3')- phosphates of uracil and thymine deoxyribonucleotides, and so protects mitochondrial DNA replication from excess dTTP. Has only marginal activity towards dIMP and dGMP NT5M 17p11.2 Mitochondrion None 8.12 25862.0 Human HUGO Gene Nomenclature Committee (HGNC) HGNC:15769 GenAtlas NT5M GeneCards NT5M GenBank Gene Database AJ277557 GenBank Protein Database 9408106 UniProtKB Q9NPB1 UniProt Accession NT5M_HUMAN 5',3'-nucleotidase, mitochondrial 5'(3')-deoxyribonucleotidase, mitochondrial precursor Deoxy-5'-nucleotidase 2 dNT-2 EC 3.1.3.- >5'(3')-deoxyribonucleotidase, mitochondrial precursor MIRLGGWCARRLCSAAVPAGRRGAAGGLGLAGGRALRVLVDMDGVLADFEGGFLRKFRAR FPDQPFIALEDRRGFWVSEQYGRLRPGLSEKAISIWESKNFFFELEPLPGAVEAVKEMAS LQNTDVFICTSPIKMFKYCPYEKYAWVEKYFGPDFLEQIVLTRDKTVVSADLLIDDRPDI TGAEPTPSWEHVLFTACHNQHLQLQPPRRRLHSWADDWKAILDSKRPC >687 bp ATGATCCGGCTGGGCGGCTGGTGTGCGCGGCGGCTCTGCAGCGCGGCGGTTCCCGCGGGG CGGCGCGGGGCGGCGGGCGGGCTGGGCCTGGCGGGAGGCCGCGCCCTACGGGTGCTGGTG GACATGGACGGCGTGCTGGCTGACTTCGAGGGCGGATTCCTCAGGAAGTTCCGCGCGCGC TTTCCCGACCAGCCCTTCATCGCGCTGGAGGACCGGCGCGGCTTCTGGGTGTCGGAGCAG TACGGCCGCCTGCGGCCAGGGCTGAGCGAGAAGGCCATCAGCATTTGGGAGTCAAAGAAT TTCTTTTTTGAACTTGAGCCTCTGCCAGGGGCCGTGGAAGCTGTCAAGGAGATGGCCAGC CTACAAAACACTGACGTCTTCATCTGCACAAGCCCCATCAAGATGTTCAAGTACTGTCCC TATGAGAAGTATGCCTGGGTGGAGAAGTACTTTGGCCCTGACTTTCTGGAGCAGATTGTG CTGACCAGAGACAAGACCGTGGTCTCTGCTGACCTTCTCATAGACGACCGGCCGGACATC ACAGGGGCCGAGCCAACCCCCAGCTGGGAGCATGTCCTCTTCACCGCCTGCCACAACCAG CACCTGCAGCTGCAGCCCCCCCGCCGCAGGCTGCACTCGTGGGCGGACGACTGGAAGGCC ATTCTGGACAGCAAGCGGCCCTGCTGA PF06941 NT5C "
rdf:type	drugbank:drugs
rdfs:label	"cyclic 3',5'-thymidine monophosphate"

All properties reside in the graph file:///home/swish/src/ClioPatria/guidelines3/drugbank_small.nt

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