Nc1cccc(C(F)(F)F)c1CC(O)CO
SMILES: Nc1cccc(C(F)(F)F)c1CC(O)CO

Molecular Processing

Molecular formula
C10H12F3NO2
Molecular weight
235.2
Exact mass
235.082
XLogP
1.18
TPSA
66.48
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
52.65

Supplementary Information

詳細情報を取得中…

1 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→