SMILES:
CCc1cnc(N2CC[C@@H](n3ncc(COc4ccc(-n5cnnn5)cc4F)n3)[C@H](F)C2)nc1Molecular Processing
Molecular formula
C21H22F2N10O
Molecular weight
468.47
Exact mass
468.1946
XLogP
2.11
TPSA
112.56
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
34
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
115.64
Supplementary Information
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