CC[C@H](NC(=O)OCc1ccccc1)c1cc(C)c(C)cc1C1CCN(C(=O)OC(C)(C)C)CC1
이름: 111
SMILES: CC[C@H](NC(=O)OCc1ccccc1)c1cc(C)c(C)cc1C1CCN(C(=O)OC(C)(C)C)CC1

Molecular Processing

Molecular formula
C29H40N2O4
Molecular weight
480.65
Exact mass
480.2988
XLogP
6.8
TPSA
67.87
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
35
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.517
Molar refractivity
138.49

Supplementary Information

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