SMILES:
COc1cccc([C@@H](Oc2ccc3c(cnn3-c3ccc(F)cc3)c2)[C@H](C)NC(=O)C(=O)OC(C)C)c1Molecular Processing
Molecular formula
C28H28FN3O5
Molecular weight
505.55
Exact mass
505.2013
XLogP
4.75
TPSA
91.68
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
37
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
136.22
Supplementary Information
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