COC(=O)c1cccc(CNC(=O)C2CC2)c1C(=O)OC
SMILES: COC(=O)c1cccc(CNC(=O)C2CC2)c1C(=O)OC

Molecular Processing

Molecular formula
C15H17NO5
Molecular weight
291.3
Exact mass
291.1107
XLogP
1.29
TPSA
81.7
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
73.69

Supplementary Information

詳細情報を取得中…

3 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→