SMILES:
COc1cc(F)cc(-c2nn(C3CCCC3)c3ncnc(N)c23)c1Molecular Processing
Molecular formula
C17H18FN5O
Molecular weight
327.36
Exact mass
327.1495
XLogP
3.34
TPSA
78.85
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
24
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.353
Molar refractivity
89.19
Supplementary Information
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