CC(=O)Nc1cccc2c1SC(C)C2
SMILES: CC(=O)Nc1cccc2c1SC(C)C2

Molecular Processing

Molecular formula
C11H13NOS
Molecular weight
207.3
Exact mass
207.0718
XLogP
2.68
TPSA
29.1
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
59.77

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→