C[C@@H]1CN(c2c(CO)cc3c(C(=O)NCC(F)F)noc3c2F)C[C@H](C)O1
SMILES: C[C@@H]1CN(c2c(CO)cc3c(C(=O)NCC(F)F)noc3c2F)C[C@H](C)O1

Molecular Processing

Molecular formula
C17H20F3N3O4
Molecular weight
387.36
Exact mass
387.1406
XLogP
2.07
TPSA
87.83
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
90.45

Supplementary Information

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