SMILES:
N#Cc1ccc2nnc(C(=O)N3CCC(c4cccc(F)c4C(F)(F)F)CC3)n2c1Molecular Processing
Molecular formula
C20H15F4N5O
Molecular weight
417.37
Exact mass
417.1213
XLogP
3.78
TPSA
74.29
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
96.98
Supplementary Information
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