Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB03053"
| Predicate | Value (sorted: none) |
|---|---|
| rdf:type | |
| ns1:description |
"
experimental
This compound belongs to the organic phosphonic acids. These are organic compounds containing phosphonic acid.
Organic Phosphonic Acids
Organic Compounds
Organophosphorus Compounds
Organic Phosphonic Acids and Derivatives
Organic Phosphonic Acids
Polyamines
Monoalkylamines
polyamine
primary amine
primary aliphatic amine
amine
organonitrogen compound
logP
-1.6
ALOGPS
logS
-0.45
ALOGPS
Water Solubility
5.45e+01 g/l
ALOGPS
logP
-2.3
ChemAxon
IUPAC Name
hydrogen (1-aminocyclopropyl)phosphonate
ChemAxon
Traditional IUPAC Name
hydrogen 1-aminocyclopropylphosphonate
ChemAxon
Molecular Weight
136.0663
ChemAxon
Monoisotopic Weight
136.016354607
ChemAxon
SMILES
NC1(CC1)[P@](O)([O-])=O
ChemAxon
Molecular Formula
C3H7NO3P
ChemAxon
InChI
InChI=1S/C3H8NO3P/c4-3(1-2-3)8(5,6)7/h1-2,4H2,(H2,5,6,7)/p-1
ChemAxon
InChIKey
InChIKey=WKCJTSHOKDLADL-UHFFFAOYSA-M
ChemAxon
Polar Surface Area (PSA)
86.38
ChemAxon
Refractivity
26.98
ChemAxon
Polarizability
10.87
ChemAxon
Rotatable Bond Count
1
ChemAxon
H Bond Acceptor Count
4
ChemAxon
H Bond Donor Count
2
ChemAxon
pKa (strongest acidic)
-0.29
ChemAxon
pKa (strongest basic)
10.06
ChemAxon
Physiological Charge
-1
ChemAxon
Number of Rings
1
ChemAxon
Bioavailability
1
ChemAxon
Rule of Five
true
ChemAxon
ChEBI
30989
PubChem Compound
194762
PubChem Substance
46508758
ChemSpider
168966
PDB
MLP
BE0001378
1-aminocyclopropane-1-carboxylate deaminase
Pseudomonas sp. (strain ACP)
# 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
1-aminocyclopropane-1-carboxylate deaminase
Amino acid transport and metabolism
Catalyzes a cyclopropane ring-opening reaction, the irreversible conversion of 1-aminocyclopropane-1-carboxylate (ACC) to ammonia and alpha-ketobutyrate. Allows growth on ACC as a nitrogen source
acdS
Cytoplasmic
None
6.52
36672.0
Pseudomonas sp. (strain ACP)
GenBank Gene Database
M73488
GenBank Protein Database
150963
UniProtKB
Q00740
UniProt Accession
1A1D_PSEUD
ACC deaminase
ACCD
EC 3.5.99.7
>1-aminocyclopropane-1-carboxylate deaminase
MNLQRFPRYPLTFGPTPIQPLARLSKHLGGKVHLYAKREDCNSGLAFGGNKTRKLEYLIP
EALAQGCDTLVSIGGIQSNQTRQVAAVAAHLGMKCVLVQENWVNYSDAVYDRVGNIQMSR
ILGADVRLVPDGFDIGFRRSWEDALESVRAAGGKPYAIPAGCSDHPLGGLGFVGFAEEVR
AQEAELGFKFDYVVVCSVTGSTQAGMVVGFAADGRADRVIGVDASAKPAQTREQITRIAR
QTAEKVGLERDIMRADVVLDERFAGPEYGLPNEGTLEAIRLCARTEGMLTDPVYEGKSMH
GMIEMVRNGEFPEGSRVLYAHLGGVPALNGYSFIFRDG
>1017 bp
ATGAACCTGCAACGATTCCCTCGTTACCCGCTGACTTTCGGGCCGACGCCAATCCAACCG
CTAGCGCGTCTGAGCAAGCACCTCGGCGGCAAAGTGCATCTGTATGCGAAACGCGAAGAC
TGCAACAGCGGCCTGGCGTTCGGTGGCAACAAGACACGCAAGCTCGAATATCTGATCCCT
GAAGCGCTTGCTCAGGGTTGCGACACGCTCGTGTCGATCGGCGGCATTCAGTCGAACCAG
ACGCGCCAGGTGGCGGCCGTGGCGGCTCATCTGGGCATGAAGTGCGTGCTGGTGCAGGAG
AACTGGGTCAACTATTCGGACGCAGTCTACGACCGCGTCGGCAACATCCAGATGTCGCGC
ATTCTCGGCGCCGATGTTCGCCTCGTGCCCGACGGCTTCGACATCGGTTTTCGCAGGAGC
TGGGAGGATGCGCTGGAAAGCGTGCGGGCGGCCGGCGGCAAGCCGTATGCGATTCCGGCA
GGCTGCTCGGATCACCCGCTCGGCGGCCTGGGTTTCGTCGGCTTCGCGGAGGAGGTGCGG
GCGCAGGAAGCCGAATTGGGCTTCAAATTCGACTATGTCGTCGTGTGTTCCGTGACCGGC
AGCACGCAGGCCGGCATGGTGGTGGGCTTCGCCGCTGACGGCCGCGCCGATCGCGTGATC
GGCGTCGACGCTTCGGCCAAACCCGCGCAGACGCGCGAGCAGATCACCCGCATCGCGAGA
CAGACCGCGGAGAAAGTCGGCCTGGAGCGCGATATCATGCGGGCCGACGTGGTGCTCGAC
GAGCGCTTCGCGGGTCCGGAATACGGATTGCCGAACGAAGGCACGCTGGAAGCGATCCGC
TTGTGCGCGCGCACGGAGGGCATGCTGACCGATCCCGTCTACGAAGGCAAATCGATGCAC
GGCATGATCGAAATGGTGCGCAACGGCGAATTTCCGGAAGGCTCGCGCGTGCTGTATGCG
CACCTCGGCGGGGTGCCGGCGTTGAACGGCTACAGCTTTATCTTCCGAGACGGCTGA
PF00291
PALP
function
hydrolase activity
function
hydrolase activity, acting on carbon-nitrogen (but not peptide) bonds
function
1-aminocyclopropane-1-carboxylate deaminase activity
function
catalytic activity
process
amino acid and derivative metabolism
process
sulfur amino acid metabolism
process
methionine metabolism
process
physiological process
process
ethylene biosynthesis
process
metabolism
process
cellular metabolism
process
amino acid metabolism
"
|
| owl:sameAs | |
| rdfs:label |
"1-Aminocyclopropylphosphonate"
|
All properties reside in the graph file:///home/swish/src/ClioPatria/guidelines/drugbank_small.nt
The resource does not appear as an object