Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB04214"
Predicate | Value (sorted: default) |
---|---|
rdfs:label |
"4-Nitrophenyl Phosphate"
|
rdf:type | |
drugbank:description |
"
330-13-2
experimental
This compound belongs to the nitrophenols and derivatives. These are compounds containing a nitrophenol moiety, which consists of a benzene ring bearing both an hydroxyl group and a nitro group on two different ring carbon atoms.
Nitrophenols and Derivatives
Organic Compounds
Benzenoids
Benzene and Substituted Derivatives
Phenols and Derivatives
Nitrobenzenes
Organophosphate Esters
Organic Phosphoric Acids
Nitro Compounds
Nitronic Acids
Organic Oxoazanium Compounds
Polyamines
phosphoric acid ester
organic phosphate
nitronic acid
nitro compound
polyamine
organic oxoazanium
organonitrogen compound
amine
Chromogenic Compounds
logP
0.5
ALOGPS
logS
-2.3
ALOGPS
Water Solubility
1.03e+00 g/l
ALOGPS
logP
0.96
ChemAxon
IUPAC Name
(4-nitrophenoxy)phosphonic acid
ChemAxon
Traditional IUPAC Name
4-nitrophenoxyphosphonic acid
ChemAxon
Molecular Weight
219.0887
ChemAxon
Monoisotopic Weight
218.993273441
ChemAxon
SMILES
OP(O)(=O)OC1=CC=C(C=C1)[N+]([O-])=O
ChemAxon
Molecular Formula
C6H6NO6P
ChemAxon
InChI
InChI=1S/C6H6NO6P/c8-7(9)5-1-3-6(4-2-5)13-14(10,11)12/h1-4H,(H2,10,11,12)
ChemAxon
InChIKey
InChIKey=XZKIHKMTEMTJQX-UHFFFAOYSA-N
ChemAxon
Polar Surface Area (PSA)
112.58
ChemAxon
Refractivity
46.24
ChemAxon
Polarizability
16.57
ChemAxon
Rotatable Bond Count
3
ChemAxon
H Bond Acceptor Count
5
ChemAxon
H Bond Donor Count
2
ChemAxon
pKa (strongest acidic)
1.78
ChemAxon
Physiological Charge
-2
ChemAxon
Number of Rings
1
ChemAxon
Bioavailability
1
ChemAxon
Rule of Five
true
ChemAxon
Ghose Filter
true
ChemAxon
ChEBI
17440
PubChem Compound
378
PubChem Substance
46506564
KEGG Compound
C03360
ChemSpider
369
BindingDB
24514
PDB
4NP
BE0003786
Low molecular weight phosphotyrosine protein phosphatase
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
Low molecular weight phosphotyrosine protein phosphatase
Signal transduction mechanisms
Acts on tyrosine phosphorylated proteins, low-MW aryl phosphates and natural and synthetic acyl phosphates. Isoform 3 does not possess phosphatase activity
ACP1
2p25
Cytoplasm
None
6.73
18042.3
Human
HUGO Gene Nomenclature Committee (HGNC)
GNC:122
GeneCards
ACP1
GenBank Gene Database
M83653
GenBank Protein Database
179636
UniProtKB
P24666
UniProt Accession
PPAC_HUMAN
Adipocyte acid phosphatase
LMW-PTP
LMW-PTPase
Low molecular weight cytosolic acid phosphatase
Red cell acid phosphatase 1
>Low molecular weight phosphotyrosine protein phosphatase
MAEQATKSVLFVCLGNICRSPIAEAVFRKLVTDQNISENWRVDSAATSGYEIGNPPDYRG
QSCMKRHGIPMSHVARQITKEDFATFDYILCMDESNLRDLNRKSNQVKTCKAKIELLGSY
DPQKQLIIEDPYYGNDSDFETVYQQCVRCCRAFLEKAH
>477 bp
ATGGCGGAACAGGCTACCAAGTCCGTGCTGTTTGTGTGTCTGGGTAACATTTGTCGATCA
CCCATTGCAGAAGCAGTTTTCAGGAAACTTGTAACCGATCAAAACATCTCAGAGAATTGG
AGGGTAGACAGCGCGGCAACTTCCGGGTATGAGATAGGGAACCCCCCTGACTACCGAGGG
CAGAGCTGCATGAAGAGGCACGGCATTCCCATGAGCCACGTTGCCCGGCAGATTACCAAA
GAAGATTTTGCCACATTTGATTATATACTATGTATGGATGAAAGCAATCTGAGAGATTTG
AATAGAAAAAGTAATCAAGTTAAAACCTGCAAAGCTAAAATTGAACTACTTGGGAGCTAT
GATCCACAAAAACAACTTATTATTGAAGATCCCTATTATGGGAATGACTCTGACTTTGAG
ACGGTGTACCAGCAGTGTGTCAGGTGCTGCAGAGCGTTCTTGGAGAAGGCCCACTGA
PF01451
LMWPc
function
protein tyrosine phosphatase activity
function
hydrolase activity
function
non-membrane spanning protein tyrosine phosphatase activity
function
hydrolase activity, acting on ester bonds
function
phosphoric ester hydrolase activity
function
phosphoric monoester hydrolase activity
function
phosphoprotein phosphatase activity
function
catalytic activity
process
metabolism
process
protein amino acid dephosphorylation
process
macromolecule metabolism
process
biopolymer metabolism
process
biopolymer modification
process
protein modification
process
physiological process
BE0003787
Dual specificity protein phosphatase 23
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
Dual specificity protein phosphatase 23
Signal transduction mechanisms
Protein phosphatase that mediates dephosphorylation of proteins phosphorylated on Tyr and Ser/Thr residues. In vitro, it can dephosphorylate p44-ERK1 (MAPK3) but not p54 SAPK-beta (MAPK10) in vitro. Able to enhance activation of JNK and p38 (MAPK14)
DUSP23
1q23.2
Cytoplasm, cytosol. Nucleus
None
8.34
16588.0
Human
HUGO Gene Nomenclature Committee (HGNC)
GNC:21480
GeneCards
DUSP23
GenBank Gene Database
AB164404
GenBank Protein Database
44916998
UniProtKB
Q9BVJ7
UniProt Accession
DUS23_HUMAN
LDP-3
Low molecular mass dual specificity phosphatase 3
VH1-like phosphatase Z
>Dual specificity protein phosphatase 23
MGVQPPNFSWVLPGRLAGLALPRLPAHYQFLLDLGVRHLVSLTERGPPHSDSCPGLTLHR
LRIPDFCPPAPDQIDRFVQIVDEANARGEAVGVHCALGFGRTGTMLACYLVKERGLAAGD
AIAEIRRLRPGSIETYEQEKAVFQFYQRTK
>453 bp
ATGGGCGTGCAGCCCCCCAACTTCTCCTGGGTGCTTCCGGGCCGGCTGGCGGGACTGGCG
CTGCCGCGGCTCCCCGCCCACTACCAGTTCCTGTTGGACCTGGGCGTGCGGCACCTGGTG
TCCCTGACGGAGCGCGGGCCCCCTCACAGCGACAGCTGCCCCGGCCTCACCCTGCACCGC
CTGCGCATCCCCGACTTCTGCCCGCCGGCCCCCGACCAGATCGACCGCTTCGTGCAGATC
GTGGACGAGGCCAACGCACGGGGAGAGGCTGTGGGAGTGCACTGTGCTCTGGGCTTTGGC
CGCACTGGCACCATGCTGGCCTGTTACCTGGTGAAGGAGCGGGGCTTGGCTGCAGGAGAT
GCCATTGCTGAAATCCGACGACTACGACCCGGCTCCATCGAGACCTATGAGCAGGAGAAA
GCAGTCTTCCAGTTCTACCAGCGAACGAAATAA
PF00782
DSPc
function
protein tyrosine/serine/threonine phosphatase activity
function
hydrolase activity
function
hydrolase activity, acting on ester bonds
function
phosphoric ester hydrolase activity
function
phosphoric monoester hydrolase activity
function
phosphoprotein phosphatase activity
function
catalytic activity
process
metabolism
process
macromolecule metabolism
process
biopolymer metabolism
process
biopolymer modification
process
protein modification
process
physiological process
process
protein amino acid dephosphorylation
"
|
drugbank:drugCategory | |
owl:sameAs |
All properties reside in the graph file:///home/swish/src/ClioPatria/guidelines3/drugbank_small.nt
The resource does not appear as an object