Cc1cc(C(=O)c2ccccc2COC2CCCCO2)on1
SMILES: Cc1cc(C(=O)c2ccccc2COC2CCCCO2)on1

Molecular Processing

Molecular formula
C17H19NO4
Molecular weight
301.34
Exact mass
301.1314
XLogP
3.26
TPSA
61.56
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
79.49

Supplementary Information

詳細情報を取得中…

4 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→