SMILES:
Clc1nc(NCc2ccccn2)c2c(Cl)ccn2n1Molecular Processing
Molecular formula
C12H9Cl2N5
Molecular weight
294.15
Exact mass
293.0235
XLogP
3.04
TPSA
55.11
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
74.57
Supplementary Information
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