General
Preferred name
PD077073
Synonyms
2-BZP ()
P&D ID
PD077073
CAS
84477-71-4
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
1
Cayman Chemical Bioactives
External IDs
9
Properties
(calculated by RDKit )
Molecular Weight
176.13
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
2
Ring Count
2
Aromatic Ring Count
1
cLogP
0.79
TPSA
24.06
Fraction CSP3
0.45
Chiral centers
1.0
Largest ring
6.0
QED
0.7
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data