SMILES:
COc1ccc(Cn2cc(-c3nc(Nc4ccccn4)sc3Cl)cn2)cc1Molecular Processing
Molecular formula
C19H16ClN5OS
Molecular weight
397.89
Exact mass
397.0764
XLogP
4.86
TPSA
64.86
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
27
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.105
Molar refractivity
107.96
Supplementary Information
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