SMILES:
N#Cc1cccc2[nH]ccc12Molecular Processing
Molecular formula
C9H6N2
Molecular weight
142.16
Exact mass
142.0531
XLogP
2.04
TPSA
39.58
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0
Molar refractivity
43.01
Supplementary Information
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