Cc1nccn1-c1ccc(Nc2nc3c(c(OS(=O)(=O)C(F)(F)F)n2)CN(C(=O)OC(C)(C)C)CC3)cc1
SMILES: Cc1nccn1-c1ccc(Nc2nc3c(c(OS(=O)(=O)C(F)(F)F)n2)CN(C(=O)OC(C)(C)C)CC3)cc1

Molecular Processing

Molecular formula
C23H25F3N6O5S
Molecular weight
554.55
Exact mass
554.1559
XLogP
4.24
TPSA
128.54
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
5
Heavy atoms
38
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.391
Molar refractivity
129.57

Supplementary Information

詳細情報を取得中…

15 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→