General
Preferred name
AY-23578
Synonyms
11-deoxy-PGE1 ()
11-deoxy Prostaglandin E1 ()
11-deoxy-PGE1 ()
P&D ID
PD021209
CAS
37786-00-8
Tags
available
drug candidate
Drug indication
Discovery agent
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION 11-Deoxy prostaglandin E1 is a synthetic analog of PGE1. The Ki values for binding to the mouse EP1, EP2, EP3, and EP4 receptors are 600, 45, 1.1, and 23 nM, respectively. (BOC Sciences Bioactive Compounds)
Compound Sets
8
Cayman Chemical Bioactives
DrugMAP
EUbOPEN Chemogenomics Library
Guide to Pharmacology
Mcule NIBR MoA Box Subset
Novartis Chemogenetic Library (NIBR MoA Box)
ReFrame library
External IDs
20
Properties
(calculated by RDKit )
Molecular Weight
338.25
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
2
Rotatable Bonds
13
Ring Count
1
Aromatic Ring Count
0
cLogP
4.5
TPSA
74.6
Fraction CSP3
0.8
Chiral centers
3.0
Largest ring
5.0
QED
0.38
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Member status
member
Recommended Cell Concentration
None
Source data