General
Preferred name
Iminodibenzyl
Synonyms
10,11-dihydro-5H-dibenzo[b,f]azepine ()
P&D ID
PD065559
CAS
494-19-9
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)
PRICE 90
DESCRIPTION Iminodibenzyl has an inhibitory effect on arachidonate 5-lipoxygenase. (Enamine Bioactive Compounds)
DESCRIPTION Iminodibenzyl is used for the intermediates of antiepileptic drug carbamazepine. (TargetMol Bioactive Compound Library)
Compound Sets
3
DrugMAP
Enamine Bioactive Compounds
TargetMol Bioactive Compound Library
External IDs
21
Properties
(calculated by RDKit )
Molecular Weight
195.1
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
0
Ring Count
3
Aromatic Ring Count
2
cLogP
3.53
TPSA
12.03
Fraction CSP3
0.14
Chiral centers
0.0
Largest ring
7.0
QED
0.68
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data