Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB03508"
| Predicate | Value (sorted: default) |
|---|---|
| rdfs:label |
"1-Ethoxy-2-(2-Methoxyethoxy)Ethane"
|
| rdf:type | |
| drugbank:description |
"
experimental
This compound belongs to the polyamines. These are compounds containing more than one amine group.
Polyamines
Organic Compounds
Organonitrogen Compounds
Amines
Polyamines
Ethers
logP
0.23
ALOGPS
logS
-0.77
ALOGPS
Water Solubility
2.53e+01 g/l
ALOGPS
logP
0.39
ChemAxon
IUPAC Name
1-ethoxy-2-(2-methoxyethoxy)ethane
ChemAxon
Traditional IUPAC Name
1-ethoxy-2-(2-methoxyethoxy)ethane
ChemAxon
Molecular Weight
148.2001
ChemAxon
Monoisotopic Weight
148.109944378
ChemAxon
SMILES
CCOCCOCCOC
ChemAxon
Molecular Formula
C7H16O3
ChemAxon
InChI
InChI=1S/C7H16O3/c1-3-9-6-7-10-5-4-8-2/h3-7H2,1-2H3
ChemAxon
InChIKey
InChIKey=CNJRPYFBORAQAU-UHFFFAOYSA-N
ChemAxon
Polar Surface Area (PSA)
27.69
ChemAxon
Refractivity
39.85
ChemAxon
Polarizability
17.62
ChemAxon
Rotatable Bond Count
7
ChemAxon
H Bond Acceptor Count
3
ChemAxon
H Bond Donor Count
0
ChemAxon
pKa (strongest basic)
-3.7
ChemAxon
Physiological Charge
0
ChemAxon
Number of Rings
0
ChemAxon
Bioavailability
1
ChemAxon
Rule of Five
true
ChemAxon
PubChem Compound
13847
PubChem Substance
46505754
PDB
ME2
"
|
| owl:sameAs |
All properties reside in the graph file:///home/swish/src/ClioPatria/guidelines2/drugbank_small.nt
The resource does not appear as an object