이름: (S)-2-amino-6-((2-tert-butoxy-2-oxoethyl)(pyridin-2-ylmethyl)amino)hexanoic acid
SMILES:
CC(C)(C)OC(=O)CN(CCCC[C@H](N)C(=O)O)Cc1ccccn1Molecular Processing
Molecular formula
C18H29N3O4
Molecular weight
351.45
Exact mass
351.2158
XLogP
1.81
TPSA
105.75
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
25
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
94.82
Supplementary Information
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