General
Preferred name
ICARIIN
Synonyms
Ieariline ()
Epimedii herba icariin ()
P&D ID
PD000540
CAS
489-32-7
Tags
drug candidate
natural product
available
Drug Status
investigational
Max Phase
Phase 3
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
13
AdooQ Bioactive Compound Library
Cayman Chemical Bioactives
ChEMBL Drugs
Drug Repurposing Hub
DrugBank
DrugMAP
Mcule NIBR MoA Box Subset
MedChem Express Bioactive Compound Library
NIH Clinical Collections (NCC)
Novartis Chemogenetic Library (NIBR MoA Box)
ReFrame library
TargetMol Bioactive Compound Library
The Spectrum Collection
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
29
Properties
(calculated by RDKit )
Molecular Weight
676.24
Hydrogen Bond Acceptors
15
Hydrogen Bond Donors
8
Rotatable Bonds
9
Ring Count
5
Aromatic Ring Count
3
cLogP
0.07
TPSA
238.2
Fraction CSP3
0.48
Chiral centers
10.0
Largest ring
6.0
QED
0.14
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolism
Autophagy
Cell Cycle/DNA Damage
Metabolic Enzyme/Protease
Vitamin D Related/Nuclear Receptor
Target
PDE5
PDE5A
Phosphodiesterase (PDE)
PPAR
Member status
member
MOA
Sorbitol dehydrogenase inhibitor
phosphodiesterase inhibitor
Source data
