SMILES:
Clc1ccc2nc(-c3ccccc3)c(-c3ccnnc3)n2n1Molecular Processing
Molecular formula
C16H10ClN5
Molecular weight
307.74
Exact mass
307.0625
XLogP
3.51
TPSA
55.97
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
84.46
Supplementary Information
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