CCOP(=O)(COC(CONc1nc(NC=O)nc(Cl)c1NC=O)COC(C)=O)OCC
SMILES: CCOP(=O)(COC(CONc1nc(NC=O)nc(Cl)c1NC=O)COC(C)=O)OCC

Molecular Processing

Molecular formula
C16H25ClN5O9P
Molecular weight
497.83
Exact mass
497.1078
XLogP
1.78
TPSA
176.3
H-bond donors
3
H-bond acceptors
12
Rotatable bonds
17
Heavy atoms
32
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
16
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
113.22

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→