이름: 5-[4-(tert-Butoxycarbonyl-methyl-amino)-cyclohexylidene]-pentanoic acid
SMILES:
CN(C(=O)OC(C)(C)C)C1CCC(=CCCCC(=O)O)CC1Molecular Processing
Molecular formula
C17H29NO4
Molecular weight
311.42
Exact mass
311.2097
XLogP
3.98
TPSA
66.84
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
22
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.765
Molar refractivity
85.82
Supplementary Information
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