General
Preferred name
PD018247
Synonyms
5S-HPETE ()
5(S)-HpETE ()
P&D ID
PD018247
CAS
71774-08-8
Tags
drug candidate
natural product
available
Drug indication
Discovery agent
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
7
Cayman Chemical Bioactives
44230
Concise Guide to Pharmacology 2017/18
2483
Concise Guide to Pharmacology 2019/20
2483
Concise Guide to Pharmacology 2021/22
2483
Concise Guide to Pharmacology 2023/24
2483
DrugMAP
DME1304
Guide to Pharmacology
2483
External IDs
26
Properties
(calculated by RDKit )
Molecular Weight
336.23
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
2
Rotatable Bonds
15
Ring Count
0
Aromatic Ring Count
0
cLogP
5.68
TPSA
66.76
Fraction CSP3
0.55
Chiral centers
1.0
Largest ring
0.0
QED
0.13
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data