General
Preferred name
DIFEMERINE
Synonyms
P&D ID
PD122329
CAS
3477-97-2
80387-96-8
Tags
drug candidate
Drug Status
experimental
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
1
DrugBank
External IDs
9
Properties
(calculated by RDKit )
Molecular Weight
327.18
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
1
Rotatable Bonds
6
Ring Count
2
Aromatic Ring Count
2
cLogP
2.81
TPSA
49.77
Fraction CSP3
0.35
Chiral centers
0.0
Largest ring
6.0
QED
0.83
QED
0.83
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data