SMILES:
Cc1cc2nc(NC(=O)C3CC3c3ccncc3)cc(Cl)n2n1Molecular Processing
Molecular formula
C16H14ClN5O
Molecular weight
327.78
Exact mass
327.0887
XLogP
2.83
TPSA
72.18
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
23
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
86.45
Supplementary Information
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