CC(C)(C#N)Nc1nc(Cl)c(C#N)c(Cl)n1
SMILES: CC(C)(C#N)Nc1nc(Cl)c(C#N)c(Cl)n1

Molecular Processing

Molecular formula
C9H7Cl2N5
Molecular weight
256.1
Exact mass
255.0079
XLogP
2.37
TPSA
85.39
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
60.08

Supplementary Information

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