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Molecule
ID:3679
Structure
Similarity
Functional Group
Text
General Information
Structure
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Molecular Formula
H₂O₂P-
Molecular Mass
64.988441
Exact Mass
64.97924093
Charge
-1
InChI
InChI=1S/HO2P/c1-3-2/h(H,1,2)/p-1
InChIKey
GQZXNSPRSGFJLY-UHFFFAOYSA-M
Canonic Smiles
[O-]P=O
Isomeric Smiles
[O-]P=O
Calculated Properties
JChem
LogD (pH = 7.4)
-2.85
LogD (pH = 5.5)
-2.85
Log P
-0.59
Rotatable Bonds
0
H Donor
0
H Acceptors
2
Lipinski's Rule of Five
true
Acid pKa
-4.07
Polar Surface Area
40.13
Polarizability
3.24
Molar Refractivity
8.09
LOG S
0.86
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Names and Identifiers
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Properties
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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General Information
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IUPAC Traditional name
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IUPAC name
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From Data Sources
Bioactivity
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Data Source
Academic Data
DrugBank
DB04053
PubChem
183145
ChEBI
CHEBI:44951
Names and Identifiers
Synonyms
Hypophosphite
dioxidophosphate(1-)
PO2(-)
phosphorus oxide anion
[PO2](-)
dioxidophosphate
IUPAC Traditional name
hypophosphite
IUPAC name
phosphinate
oxophosphinite
Registration numbers
PubChem CID
183145
PubChem SID
46505530
160967117
26697117
UniProt Database
O69060
O69061
O69063
O69066
O69064
O69062
O69067
CompTox Database
DTXSID10154048
PDBeChem Database
PO2
Protein Data Bank
1vq5
3hll
7c0k
1vqp
1vqm
1h4k
7c0x
7c19
1vq4
3i55
7c0f
CHEBI ID
CHEBI:44950
CHEBI:36362
CHEBI:44951
DrugBank ID
DB04053
Rhea Database
RHEA:37127
ACToR Database
12359-19-2
CAS Number
20499-58-5
Related Proteins
PDB Bank
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1VQ5
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3HLL
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7C0K
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1VQP
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1VQM
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1H4K
7C0X
7C19
1VQ4
3I55
7C0F
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay
Registration numbers
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PubChem CID
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PubChem SID
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UniProt Database
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CompTox Database
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PDBeChem Database
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Protein Data Bank
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CHEBI ID
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DrugBank ID
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Rhea Database
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ACToR Database
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CAS Number
Molecule Details
DrugBank
DB04053
Drug information: experimental
ChEBI
CHEBI:44951
A monovalent inorganic anion obtained by deprotonation of hydroxyphosphanone.
Molecule Details
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DrugBank
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ChEBI