SMILES:
O=C(Nc1cccc(C(F)(F)F)c1)n1ccc2cc(Oc3ncnc4c3CN(CCO)C4)ccc21Molecular Processing
Molecular formula
C24H20F3N5O3
Molecular weight
483.45
Exact mass
483.1518
XLogP
4.63
TPSA
92.51
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
35
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.208
Molar refractivity
121.1
Supplementary Information
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