Name: 2-benzyl-6-[(3R,4R)-3,4-dihydroxypyrrolidin-1-yl]pyridine
SMILES:
O[C@@H]1CN(c2cccc(Cc3ccccc3)n2)C[C@H]1OMolecular Processing
Molecular formula
C16H18N2O2
Molecular weight
270.33
Exact mass
270.1368
XLogP
1.21
TPSA
56.59
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
77.71
Supplementary Information
Details werden geladen…
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