Name: (R)-N-Boc-allylglycine
SMILES:
C1CCC(NC2CCCCC2)CC1.C=CCC(NC(=O)OC(C)(C)C)C(=O)OMolecular Processing
Molecular formula
C22H40N2O4
Molecular weight
396.57
Exact mass
396.2988
XLogP
4.78
TPSA
87.66
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
28
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.818
Molar refractivity
112.49
Supplementary Information
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