General
Preferred name
SCUTELLARIN
Synonyms
Breviscapinun ()
Breviscapine ()
Scutellarein-7-glucuronide ()
Breviscapin ()
Scutellarin B ()
Breviscapine, Breviscapin, Scutellarein-7-glucuronide ()
P&D ID
PD063606
CAS
27740-01-8
1329-06-2
116122-36-2
Tags
natural product
drug candidate
available
Drug indication
Cerebrovascular ischaemia
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Cell lines
3
Organisms
0
Compound Sets
7
AdooQ Bioactive Compound Library
Cayman Chemical Bioactives
DrugMAP
Guide to Pharmacology
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
25
Properties
(calculated by RDKit )
Molecular Weight
462.08
Hydrogen Bond Acceptors
11
Hydrogen Bond Donors
7
Rotatable Bonds
4
Ring Count
4
Aromatic Ring Count
3
cLogP
-0.15
TPSA
207.35
Fraction CSP3
0.24
Chiral centers
5.0
Largest ring
6.0
QED
0.25
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Pathway
JAK/STAT Signaling
PI3K/Akt/mTOR signaling
Stem Cells
Anti-infection
PI3K/Akt/mTOR
Stem Cell/Wnt
Target
Akt
STAT
HIV
Akt,NF-¦ÊB,STAT
MOA
AKT
Source data