Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB02042"
| Predicate | Value (sorted: default) |
|---|---|
| rdfs:label |
"2-(2-{2-[2-(2-Methoxy-Ethoxy)-Ethoxy]-Ethoxy}-Ethoxy)-Ethanol"
|
| 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
Primary Alcohols
Ethers
alcohol
logP
-0.42
ALOGPS
logS
-1.8
ALOGPS
Water Solubility
4.22e+00 g/l
ALOGPS
logP
-0.75
ChemAxon
IUPAC Name
2,5,8,11,14-pentaoxahexadecan-16-ol
ChemAxon
Traditional IUPAC Name
2,5,8,11,14-pentaoxahexadecan-16-ol
ChemAxon
Molecular Weight
252.3047
ChemAxon
Monoisotopic Weight
252.1572885
ChemAxon
SMILES
COCCOCCOCCOCCOCCO
ChemAxon
Molecular Formula
C11H24O6
ChemAxon
InChI
InChI=1S/C11H24O6/c1-13-4-5-15-8-9-17-11-10-16-7-6-14-3-2-12/h12H,2-11H2,1H3
ChemAxon
InChIKey
InChIKey=SLNYBUIEAMRFSZ-UHFFFAOYSA-N
ChemAxon
Polar Surface Area (PSA)
66.38
ChemAxon
Refractivity
63.48
ChemAxon
Polarizability
29.33
ChemAxon
Rotatable Bond Count
14
ChemAxon
H Bond Acceptor Count
6
ChemAxon
H Bond Donor Count
1
ChemAxon
pKa (strongest acidic)
15.12
ChemAxon
pKa (strongest basic)
-2.7
ChemAxon
Physiological Charge
0
ChemAxon
Number of Rings
0
ChemAxon
Bioavailability
1
ChemAxon
Rule of Five
true
ChemAxon
PubChem Compound
90255
PubChem Substance
46507262
ChemSpider
81480
PDB
1PG
BE0002498
ActVA 6 protein
Streptomyces coelicolor
unknown
ActVA 6 protein
Involved in oxidoreductase activity
actVA 6
None
4.75
12100.0
Streptomyces coelicolor
GenBank Gene Database
X58833
UniProtKB
Q53908
UniProt Accession
Q53908_STRCH
Hypothetical protein SCO5081
>ActVA 6 protein
MAEVNDPRVGFVAVVTFPVDGPATQHKLVELATGGVQEWIREVPGFLSATYHASTDGTAV
VNYAQWESEQAYRVNFGADPRSAELREALSSLPGLMGPPKAVFMTPRGAILPS
>342 bp
ATGGCTGAAGTGAACGATCCCCGGGTGGGCTTCGTCGCGGTCGTCACCTTCCCGGTGGAC
GGCCCCGCCACCCAGCACAAGCTGGTGGAGCTGGCCACCGGCGGGGTGCAGGAGTGGATC
CGCGAGGTGCCCGGCTTCCTGTCGGCCACGTATCACGCGAGCACGGACGGGACCGCGGTC
GTCAACTACGCCCAGTGGGAGAGCGAGCAGGCCTACCGGGTGAACTTCGGCGCCGACCCG
CGCTCGGCGGAGCTGCGGGAGGCGCTGAGCTCGCTGCCCGGGCTCATGGGGCCGCCGAAG
GCCGTGTTCATGACTCCGCGGGGGGCGATCCTGCCGTCCTGA
PF03992
ABM
component
cell
component
intracellular
component
cytoplasm
function
oxidoreductase activity
function
catalytic activity
process
metabolism
process
cellular metabolism
process
drug metabolism
process
antibiotic metabolism
process
antibiotic biosynthesis
process
physiological process
BE0002696
mRNA interferase EndoA
Bacillus subtilis (strain 168)
unknown
mRNA interferase EndoA
Involved in DNA binding
Yields cleavage products with 3' phosphate and 5' hydroxyl groups. Overexpression is toxic for cell growth, probably by inhibiting protein synthesis through the cleavage of single- stranded RNA. The toxicity is reversed by the antitoxin EndoAI
ndoA
Cytoplasmic
None
4.88
12978.0
Bacillus subtilis (strain 168)
GenBank Gene Database
AB001488
UniProtKB
P96622
UniProt Accession
ENDOA_BACSU
EC 3.1.-.-
>Endoribonuclease EndoA
MIVKRGDVYFADLSPVVGSEQGGVRPVLVIQNDIGNRFSPTAIVAAITAQIQKAKLPTHV
EIDAKRYGFERDSVILLEQIRTIDKQRLTDKITHLDDEMMDKVDEALQISLALIDF
>351 bp
TTGATTGTGAAACGCGGCGATGTTTATTTTGCTGATTTATCTCCTGTTGTTGGCTCAGAG
CAAGGCGGGGTGCGCCCGGTTTTAGTGATCCAAAATGACATCGGAAATCGCTTCAGCCCA
ACTGCTATTGTTGCAGCCATAACAGCACAAATACAGAAAGCGAAATTACCAACCCACGTC
GAAATCGATGCAAAACGCTACGGTTTTGAAAGAGATTCCGTTATTTTGCTGGAGCAAATT
CGGACGATTGACAAGCAAAGGTTAACGGATAAGATTACTCATCTGGATGATGAAATGATG
GATAAGGTTGATGAAGCCTTACAAATCAGTTTGGCACTCATTGATTTTTAG
PF02452
PemK
function
DNA binding
function
binding
function
nucleic acid binding
"
|
| 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