hypoxanthine
C₅H₄N₄O·136.110 g/mol·CID 135398638
IUPAC: 1,7-dihydropurin-6-one
Also known as: 68-94-0, 6-Hydroxypurine, 9H-Purin-6-ol, 7H-Purin-6-ol, Sarkin (+14 more)
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
136.110g/mol
Exact Mass
136.038511Da
Monoisotopic Mass
136.038511Da
XLogP
-0.5
Polar Surface Area
70.1Ų
Complexity
190
Formal Charge
0
H-Bond Donors
2
H-Bond Acceptors
3
Rotatable Bonds
0
Heavy Atoms
10
Stereo Centers
0
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 136.1 g/mol
MW ≤ 500
✓ -0.5
LogP ≤ 5
✓ 2
H-bond donors ≤ 5
✓ 3
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted
GHS Hazard Classification
Warning
Hazards
H315Causes skin irritationH319Causes serious eye irritationH335May cause respiratory irritation
Source: PubChem GHS Classification. Always consult the SDS for handling.
Chemical IdentifiersSMILES · InChI
InChI
InChI=1S/C5H4N4O/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10)