General
Preferred name
PD019872
Synonyms
1,2-Dihexanoyl-sn-glycerol ()
P&D ID
PD019872
CAS
30403-47-5
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
Cayman Chemical Bioactives
External IDs
15
Properties
(calculated by RDKit )
Molecular Weight
288.19
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
1
Rotatable Bonds
12
Ring Count
0
Aromatic Ring Count
0
cLogP
2.59
TPSA
72.83
Fraction CSP3
0.87
Chiral centers
1.0
Largest ring
0.0
QED
0.44
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data