General
Preferred name
CARVEDILOL PHOSPHATE
Synonyms
Carvedilol phosphate hemihydrate ()
P&D ID
PD055248
CAS
610309-89-2
Tags
available
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
1
CZ-OPENSCREEN Bioactive Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
9
Properties
(calculated by RDKit )
Molecular Weight
522.18
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
6
Rotatable Bonds
10
Ring Count
4
Aromatic Ring Count
4
cLogP
1.98
TPSA
185.0
Fraction CSP3
0.25
Chiral centers
1.0
Largest ring
6.0
QED
0.13
Structural alerts
2
aggregator (Aggregator Advisor)
Aggregators
aggregator (ZINC)
Aggregators
Related compounds
Custom attributes
(extracted from source data)
Source data
