SMILES:
CC#CCOc1ncnc(N2CCC(C)CCC2C)c1FMolecular Processing
Molecular formula
C16H22FN3O
Molecular weight
291.37
Exact mass
291.1747
XLogP
3.03
TPSA
38.25
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
80.76
Supplementary Information
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