COc1cccc([C@@H](Oc2ccc3c(cnn3-c3ccc(F)cc3)c2)[C@H](C)NC(=O)c2ccc(C(F)(F)F)cc2)c1
SMILES: COc1cccc([C@@H](Oc2ccc3c(cnn3-c3ccc(F)cc3)c2)[C@H](C)NC(=O)c2ccc(C(F)(F)F)cc2)c1

Molecular Processing

Molecular formula
C31H25F4N3O3
Molecular weight
563.55
Exact mass
563.1832
XLogP
7.13
TPSA
65.38
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
41
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.161
Molar refractivity
145.76

Supplementary Information

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