이름: 3-(aminomethyl)-4-methyl-6-(phenylmethyl)-2(1H)-pyridinone
SMILES:
Cc1cc(Cc2ccccc2)[nH]c(=O)c1CNMolecular Processing
Molecular formula
C14H16N2O
Molecular weight
228.29
Exact mass
228.1263
XLogP
1.73
TPSA
58.88
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
68.94
Supplementary Information
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