SMILES:
N#Cc1nccnc1ClMolecular Processing
Molecular formula
C5H2ClN3
Molecular weight
139.54
Exact mass
138.9937
XLogP
1
TPSA
49.57
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
31.76
Supplementary Information
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