SMILES:
CC(C)c1n[nH]c2c(Nc3cccc(Cl)c3)nc(Cl)nc12Molecular Processing
Molecular formula
C14H13Cl2N5
Molecular weight
322.2
Exact mass
321.0548
XLogP
4.53
TPSA
66.49
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
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
0.214
Molar refractivity
85.52
Supplementary Information
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