SMILES:
Fc1ccc2c(N3CCNCC3)n[nH]c2c1Molecular Processing
Molecular formula
C11H13FN4
Molecular weight
220.25
Exact mass
220.1124
XLogP
1.11
TPSA
43.95
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
61.13
Supplementary Information
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