SMILES:
COc1cc(N2CCN(C(=O)Cn3nc(-c4ccccn4)c(Cl)c3C)C(C)C2)c(F)cc1ClMolecular Processing
Molecular formula
C23H24Cl2FN5O2
Molecular weight
492.38
Exact mass
491.1291
XLogP
4.45
TPSA
63.49
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
126.56
Supplementary Information
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