SMILES:
Cc1c(C)c2c(c(C)c1N)CC(C)(CN1CCCC1)O2Molecular Processing
Molecular formula
C17H26N2O
Molecular weight
274.41
Exact mass
274.2045
XLogP
2.98
TPSA
38.49
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.647
Molar refractivity
83.48
Supplementary Information
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