General
Preferred name
PROPANE
Synonyms
N-propane ()
E944 ()
Purifrigor p 3.5 ()
A-108 ()
INS-944 ()
E-944 ()
INS NO.944 ()
n-Propane Residual Solvent (CRM)n-Propane Residual Solvent (CRM) ()
P&D ID
PD117486
CAS
68920-07-0
68606-26-8
68476-49-3
68476-40-4
68475-58-1
74-98-6
68527-16-2
Tags
available
drug candidate
Drug indication
Aerosol Propellant
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
2
Cayman Chemical Bioactives
ChEMBL Drugs
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
34
Properties
(calculated by RDKit )
Molecular Weight
44.06
Hydrogen Bond Acceptors
0
Hydrogen Bond Donors
0
Rotatable Bonds
0
Ring Count
0
Aromatic Ring Count
0
cLogP
1.42
TPSA
0.0
Fraction CSP3
1.0
Chiral centers
0.0
Largest ring
0.0
QED
0.39
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
