COc1ccc(-c2ccc(S(=O)(=O)NC(CC(O)CNc3ccccc3)C(=O)O)cc2)cc1
SMILES: COc1ccc(-c2ccc(S(=O)(=O)NC(CC(O)CNc3ccccc3)C(=O)O)cc2)cc1

Molecular Processing

Molecular formula
C24H26N2O6S
Molecular weight
470.55
Exact mass
470.1512
XLogP
2.96
TPSA
124.96
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
33
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.208
Molar refractivity
125.73

Supplementary Information

詳細情報を取得中…

6 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→