CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)OCC(=O)C4(O)C(C)CC5C6CCC7=CC(=O)C=CC7(C)C6(F)C(O)CC54C)cn1c23
SMILES: CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)OCC(=O)C4(O)C(C)CC5C6CCC7=CC(=O)C=CC7(C)C6(F)C(O)CC54C)cn1c23

Molecular Processing

Molecular formula
C40H47F2N3O8
Molecular weight
735.83
Exact mass
735.3331
XLogP
3.92
TPSA
138.61
H-bond donors
2
H-bond acceptors
10
Rotatable bonds
5
Heavy atoms
53
Rings
8
Aromatic rings
2
Saturated rings
4
Aliphatic rings
6
Stereo centers
9
Undefined stereo
9
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
191.22

Supplementary Information

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