General
Preferred name
beta-carotene
Synonyms
P&D ID
PD055758
Tags
natural product
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
1
DrugMatrix
External IDs
75
Properties
(calculated by RDKit )
Molecular Weight
536.44
Hydrogen Bond Acceptors
0
Hydrogen Bond Donors
0
Rotatable Bonds
10
Ring Count
2
Aromatic Ring Count
0
cLogP
12.61
TPSA
0.0
Fraction CSP3
0.45
Chiral centers
0.0
Largest ring
6.0
QED
0.24
Structural alerts
1
Singlet oxygen quenching
Nuisance compounds in cellular assays
Custom attributes
(extracted from source data)
Source data