Name: (1S)-1-(4H-1,2,4-triazol-3-yl)ethanamine
SMILES:
C[C@H](N)c1nnc[nH]1Molecular Processing
Molecular formula
C4H8N4
Molecular weight
112.14
Exact mass
112.0749
XLogP
-0.18
TPSA
67.59
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
8
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
28.99
Supplementary Information
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