Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB03872"
| Predicate | Value (sorted: none) |
|---|---|
| owl:sameAs | |
| rdfs:label |
"2,3-Dideoxyfucose"
|
| ns1:description |
"
experimental
This compound belongs to the oxanes. These are compounds containing an oxane(tetrahydropyran) ring, which is a six-member saturated aliphatic heterocycle with one oxygen atom and five carbon atoms.
Oxanes
Organic Compounds
Heterocyclic Compounds
Oxanes
Secondary Alcohols
Hemiacetals
Polyamines
hemiacetal
secondary alcohol
ether
polyamine
alcohol
logP
-0.58
ALOGPS
logS
0.73
ALOGPS
Water Solubility
7.07e+02 g/l
ALOGPS
logP
-0.28
ChemAxon
IUPAC Name
(2S,5R,6S)-6-methyloxane-2,5-diol
ChemAxon
Traditional IUPAC Name
2,3-dideoxyfucose
ChemAxon
Molecular Weight
132.1577
ChemAxon
Monoisotopic Weight
132.07864425
ChemAxon
SMILES
C[C@@H]1O[C@H](O)CC[C@H]1O
ChemAxon
Molecular Formula
C6H12O3
ChemAxon
InChI
InChI=1S/C6H12O3/c1-4-5(7)2-3-6(8)9-4/h4-8H,2-3H2,1H3/t4-,5+,6-/m0/s1
ChemAxon
InChIKey
InChIKey=ZCYMCBOUZXAAJG-JKUQZMGJSA-N
ChemAxon
Polar Surface Area (PSA)
49.69
ChemAxon
Refractivity
32.08
ChemAxon
Polarizability
13.71
ChemAxon
Rotatable Bond Count
0
ChemAxon
H Bond Acceptor Count
3
ChemAxon
H Bond Donor Count
2
ChemAxon
pKa (strongest acidic)
12.45
ChemAxon
pKa (strongest basic)
-3.2
ChemAxon
Physiological Charge
0
ChemAxon
Number of Rings
1
ChemAxon
Bioavailability
1
ChemAxon
Rule of Five
true
ChemAxon
PubChem Compound
46936814
PubChem Substance
46506455
PDB
CDR
"
|
| rdf:type |
All properties reside in the graph file:///home/swish/src/ClioPatria/guidelines/drugbank_small.nt
The resource does not appear as an object