homo-ser
C₄H₉NO₃·119.120 g/mol·CID 6971022
IUPAC: (2S)-2-azaniumyl-4-hydroxybutanoate
Also known as: L-homoserine zwitterion, CHEBI:57476
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
119.120g/mol
Exact Mass
119.058243Da
Monoisotopic Mass
119.058243Da
XLogP
-3.0
Polar Surface Area
88.0Ų
Complexity
77
Formal Charge
0
H-Bond Donors
2
H-Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
8
Stereo Centers
1
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 119.1 g/mol
MW ≤ 500
✓ -3.0
LogP ≤ 5
✓ 2
H-bond donors ≤ 5
✓ 3
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted
Chemical IdentifiersSMILES · InChI
InChI
InChI=1S/C4H9NO3/c5-3(1-2-6)4(7)8/h3,6H,1-2,5H2,(H,7,8)/t3-/m0/s1
Isomers8 compounds with formula C₄H₉NO₃
(2S,3R)-2-amino-3-hydroxybutanoic acid
CID 6288 · 119.1 g/mol
(2S)-2-amino-4-hydroxybutanoic acid
CID 12647 · 119.1 g/mol
2-amino-3-hydroxybutanoic acid
CID 205 · 119.1 g/mol
(2S,3S)-2-amino-3-hydroxybutanoic acid
CID 99289 · 119.1 g/mol
(2S,3R)-2-azaniumyl-3-hydroxybutanoate
CID 6971019 · 119.1 g/mol
(2R,3S)-2-amino-3-hydroxybutanoic acid
CID 69435 · 119.1 g/mol
4-amino-3-hydroxybutanoic acid
CID 2149 · 119.1 g/mol
2-methyl-2-nitropropan-1-ol
CID 6442 · 119.1 g/mol