General
Preferred name
cyanotriphenylborate
Synonyms
SODIUM CYANOTRIPHENYLBORATE HYDRATE ()
P&D ID
PD051822
CAS
14568-16-2
Tags
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION This compound is also used in complex with sodium (CID 23665403). (GtoPdb)
Compound Sets
6
Concise Guide to Pharmacology 2017/18
2368
Concise Guide to Pharmacology 2019/20
2368
Concise Guide to Pharmacology 2021/22
2368
Concise Guide to Pharmacology 2023/24
2368
DrugMatrix
Guide to Pharmacology
2368
External IDs
13
Properties
(calculated by RDKit )
Molecular Weight
268.13
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
0
Rotatable Bonds
3
Ring Count
3
Aromatic Ring Count
3
cLogP
2.22
TPSA
23.79
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.67
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data