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PredicateValue (sorted: none)
rdfs:label
"(3s)-3-Amino-1-(Cyclopropylamino)Heptane-2,2-Diol"
ns1:description
" experimental This compound belongs to the polyamines. These are compounds containing more than one amine group. Polyamines Organic Compounds Organonitrogen Compounds Amines Polyamines Carbonyl Hydrates Dialkylamines Monoalkylamines primary aliphatic amine primary amine logP 0.12 ALOGPS logS -0.64 ALOGPS Water Solubility 4.68e+01 g/l ALOGPS logP 0.48 ChemAxon IUPAC Name (3S)-3-amino-1-(cyclopropylamino)heptane-2,2-diol ChemAxon Traditional IUPAC Name (3S)-3-amino-1-(cyclopropylamino)heptane-2,2-diol ChemAxon Molecular Weight 202.2939 ChemAxon Monoisotopic Weight 202.168127958 ChemAxon SMILES [H][C@](N)(CCCC)C(O)(O)CNC1CC1 ChemAxon Molecular Formula C10H22N2O2 ChemAxon InChI InChI=1S/C10H22N2O2/c1-2-3-4-9(11)10(13,14)7-12-8-5-6-8/h8-9,12-14H,2-7,11H2,1H3/t9-/m0/s1 ChemAxon InChIKey InChIKey=AYBDGNNJGBFOBQ-VIFPVBQESA-N ChemAxon Polar Surface Area (PSA) 78.51 ChemAxon Refractivity 55.43 ChemAxon Polarizability 23.67 ChemAxon Rotatable Bond Count 7 ChemAxon H Bond Acceptor Count 4 ChemAxon H Bond Donor Count 4 ChemAxon pKa (strongest acidic) 11.2 ChemAxon pKa (strongest basic) 9.33 ChemAxon Physiological Charge 2 ChemAxon Number of Rings 1 ChemAxon Bioavailability 1 ChemAxon Rule of Five true ChemAxon Ghose Filter true ChemAxon PubChem Compound 448219 PubChem Substance 46508189 ChemSpider 395092 PDB M1C BE0001319 Methionine aminopeptidase Staphylococcus aureus (strain MW2) # Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. "Pubmed":http://www.ncbi.nlm.nih.gov/pubmed/17139284 # Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. "Pubmed":http://www.ncbi.nlm.nih.gov/pubmed/17016423 unknown Methionine aminopeptidase Translation, ribosomal structure and biogenesis Removes the amino-terminal methionine from nascent proteins map Cytoplasmic None 4.94 27503.0 Staphylococcus aureus (strain MW2) GenBank Gene Database BA000033 GenBank Protein Database 21204998 UniProtKB P0A079 UniProt Accession MAP1_STAAW EC 3.4.11.18 MAP Peptidase M >Methionine aminopeptidase MIVKTEEELQALKEIGYICAKVRNTMQAATKPGITTKELDNIAKELFEEYGAISAPIHDE NFPGQTCISVNEEVAHGIPSKRVIREGDLVNIDVSALKNGYYADTGISFVVGESDDPMKQ KVCDVATMAFENAIAKVKPGTKLSNIGKAVHNTARQNDLKVIKNLTGHGVGLSLHEAPAH VLNYFDPKDKTLLTEGMVLAIEPFISSNASFVTEGKNEWAFETSDKSFVAQIEHTVIVTK DGPILTTKIEEE >759 bp CTATTCTTCTTCAATTTTTGTCGTTAAAATCGGACCATCCTTAGTCACGATAACCGTATG CTCAATTTGAGCAACAAAACTTTTATCGCTCGTTTCAAAAGCCCATTCATTTTTACCTTC TGTAACAAATGATGCATTTGATGAGATAAACGGTTCAATAGCTAATACCATACCTTCAGT TAATAATGTTTTGTCTTTTGGATCAAAGTAATTAAGTACATGTGCTGGTGCTTCATGTAA TGATAAACCAACACCATGACCTGTTAAGTTTTTAATGACTTTCAAATCATTTTGTCTAGC TGTATTATGCACCGCTTTACCAATGTTACTTAACTTAGTACCCGGTTTTACTTTTGCAAT TGCATTCTCAAATGCCATCGTTGCTACGTCACATACTTTTTGTTTCATTGGATCATCTGA TTCTCCAACGACAAATGAAATGCCTGTATCTGCATAATAGCCATTCTTCAAAGCCGATAC ATCAATATTTACTAAATCTCCTTCACGAATGACACGCTTACTTGGAATCCCATGTGCCAC CTCTTCATTGACACTAATACACGTTTGACCAGGAAAATTTTCATCATGAATTGGCGCAGA AATAGCACCGTATTCTTCAAATAACTCTTTCGCAATATTATCAAGCTCTTTCGTAGTGAT ACCTGGTTTGGTTGCAGCTTGCATTGTATTGCGCACTTTAGCGCATATGTATCCAATTTC TTTTAACGCTTGTAATTCTTCTTCTGTTTTTACAATCAT PF00557 Peptidase_M24 function peptidase activity function metallopeptidase activity function exopeptidase activity function metalloexopeptidase activity function catalytic activity function aminopeptidase activity function methionyl aminopeptidase activity function hydrolase activity process protein metabolism process cellular protein metabolism process proteolysis process physiological process process metabolism process macromolecule metabolism BE0004187 Methionine aminopeptidase Staphylococcus aureus (strain Mu50 / ATCC 700699) # 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 Methionine aminopeptidase Translation, ribosomal structure and biogenesis Removes the amino-terminal methionine from nascent proteins map Cytoplasmic None 4.94 27502.1 Staphylococcus aureus (strain Mu50 / ATCC 700699) GeneCards map GenBank Gene Database BA000017 GenBank Protein Database 14245768 UniProtKB P0A078 UniProt Accession MAP1_STAAM MAP Peptidase M >Methionine aminopeptidase MIVKTEEELQALKEIGYICAKVRNTMQAATKPGITTKELDNIAKELFEEYGAISAPIHDE NFPGQTCISVNEEVAHGIPSKRVIREGDLVNIDVSALKNGYYADTGISFVVGESDDPMKQ KVCDVATMAFENAIAKVKPGTKLSNIGKAVHNTARQNDLKVIKNLTGHGVGLSLHEAPAH VLNYFDPKDKTLLTEGMVLAIEPFISSNASFVTEGKNEWAFETSDKSFVAQIEHTVIVTK DGPILTTKIEEE >1362 bp ATGTCGGAAAAAGAAATTTGGGAAAAAGTGCTTGAAATTGCTCAAGAAAAATTATCAGCT GTAAGTTACTCAACTTTCCTAAAAGATACTGAGCTTTACACGATTAAAGATGGTGAAGCT ATCGTATTATCGAGTATTCCTTTTAATGCAAATTGGTTAAATCAACAATATGCTGAAATT ATCCAAGCAATCTTATTTGATGTTGTAGGCTATGAAGTTAAACCTCACTTTATTACTACT GAAGAATTAGCAAATTATAGTAATAATGAAACTGCTACTCCAAAAGAAACAACAAAACCT TCTACTGAAACAACTGAGGATAATCATGTGCTTGGTAGAGAGCAATTCAATGCCCATAAC ACATTTGACACTTTTGTAATCGGACCTGGTAACCGCTTTCCACATGCAGCAAGTTTAGCT GTAGCCGAAGCACCAGCCAAAGCGTACAATCCATTATTTATCTATGGAGGGGTTGGTTTA GGAAAAACCCATTTAATGCATGCCATTGGTCATCATGTTTTAGATAATAATCCAGATGCC AAAGTGATTTACACATCAAGTGAAAAATTCACAAATGAATTTATTAAATCAATTCGTGAT AACGAAGGTGAAGCTTTCAGAGAAAGATATCGTAATATCGACGTCTTATTAATCGATGAT ATTCAGTTCATACAAAATAAAGTACAAACACAAGAAGAATTTTTCTATACTTTTAATGAA TTGCATCAGAATAACAAGCAAATAGTTATTTCGAGTGATCGACCACCAAAGGAAATTGCA CAATTAGAAGACCGATTACGTTCACGCTTTGAATGGGGGCTAATTGTTGATATTACGCCA CCAGATTATGAAACTCGAATGGCAATTTTGCAGAAGAAAATTGAAGAAGAAAAATTAGAT ATTCCACCAGAAGCTTTAAATTATATAGCAAATCAAATTCAATCTAATATTCGTGAATTA GAAGGTGCATTAACACGTTTACTTGCATATTCACAATTATTAGGAAAACCAATTACAACT GAATTAACTGCTGAAGCTTTAAAAGATATCATTCAAGCACCAAAATCTAAAAAGATTACC ATCCAAGATATTCAAAAAATTGTAGGCCAGTACTATAATGTTAGGATTGAAGATTTCAGT GCAAAAAAACGTACAAAGTCAATTGCATATCCGCGTCAAATAGCTATGTACTTGTCTAGA GAGCTTACAGATTTCTCATTACCTAAAATTGGTGAAGAATTTGGTGGGCGTGATCATACG ACCGTCATTCATGCTCATGAAAAAATATCTAAAGATTTAAAAGAAGATCCTATTTTTAAA CAAGAAGTAGAGAATCTTGAAAAAGAAATAAGAAATGTATAA PF00557 Peptidase_M24 function catalytic activity function aminopeptidase activity function methionyl aminopeptidase activity function hydrolase activity function peptidase activity function metallopeptidase activity function exopeptidase activity function metalloexopeptidase activity process metabolism process macromolecule metabolism process protein metabolism process cellular protein metabolism process proteolysis process physiological process "
owl:sameAs
?:EXPT02083
rdf:type
ns1:drugs

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

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