SMILES:
COc1cccc(N2CCN(C(=O)c3c(-c4cccc(F)c4)noc3N)CC2)c1Molecular Processing
Molecular formula
C21H21FN4O3
Molecular weight
396.42
Exact mass
396.1598
XLogP
3.03
TPSA
84.83
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
107.42
Supplementary Information
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