CCN(CC)C(=O)c1ccc([C@H]2CC[C@H](NC(=O)OCc3ccccc3)CC2)cc1
名称: ( iii )
SMILES: CCN(CC)C(=O)c1ccc([C@H]2CC[C@H](NC(=O)OCc3ccccc3)CC2)cc1

Molecular Processing

Molecular formula
C25H32N2O3
Molecular weight
408.54
Exact mass
408.2413
XLogP
5.12
TPSA
58.64
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.44
Molar refractivity
118.45

Supplementary Information

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