O=C(O)CC[C@H](NC(=O)C(F)(F)F)C(=O)OCc1ccccc1
SMILES: O=C(O)CC[C@H](NC(=O)C(F)(F)F)C(=O)OCc1ccccc1

Molecular Processing

Molecular formula
C14H14F3NO5
Molecular weight
333.26
Exact mass
333.0824
XLogP
1.64
TPSA
92.7
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
71.09

Supplementary Information

詳細情報を取得中…

2 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→