CC1(C)C(=O)NC(=O)N1CCNc1ncc(C(F)(F)F)c(-c2cc3cc(N)ccc3s2)n1
SMILES: CC1(C)C(=O)NC(=O)N1CCNc1ncc(C(F)(F)F)c(-c2cc3cc(N)ccc3s2)n1

Molecular Processing

Molecular formula
C20H19F3N6O2S
Molecular weight
464.47
Exact mass
464.1242
XLogP
3.7
TPSA
113.24
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
115.08

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→