CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3c(c2)NC(=O)CN(CCC(F)(F)F)C3)ncc1Cl
SMILES: CNC(=O)c1cccc(F)c1Nc1nc(Nc2ccc3c(c2)NC(=O)CN(CCC(F)(F)F)C3)ncc1Cl

Molecular Processing

Molecular formula
C24H22ClF4N7O2
Molecular weight
551.93
Exact mass
551.146
XLogP
4.82
TPSA
111.28
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
38
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
134.42

Supplementary Information

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