CNC(=O)c1c(-c2ccc(F)cc2)oc2ccc(-c3cc(C(=O)NC4(c5cn(C)cn5)CC4)ccc3C)cc12
SMILES: CNC(=O)c1c(-c2ccc(F)cc2)oc2ccc(-c3cc(C(=O)NC4(c5cn(C)cn5)CC4)ccc3C)cc12

Molecular Processing

Molecular formula
C31H27FN4O3
Molecular weight
522.58
Exact mass
522.2067
XLogP
5.73
TPSA
89.16
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
39
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.194
Molar refractivity
146.76

Supplementary Information

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