名称: 2-Amino-4-cyano-butyric acid
SMILES:
N#CCCC(N)C(=O)OMolecular Processing
Molecular formula
C5H8N2O2
Molecular weight
128.13
Exact mass
128.0586
XLogP
-0.3
TPSA
87.11
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
30.46
Supplementary Information
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