COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK378357
Chemical Name: 2,2,2-trichloro-1-(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-yl)ethylbenzenesulfonate
Smiles: CC1(C)COP(=O)(OC1)C(C(Cl)(Cl)Cl)OS(=O)(=O)c1ccccc1

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Molecular Weight: 437.66
Empirical Formula: C13H16Cl3O6PS

Physical State: Dry powder
Available Amount: 2868 mg

Lipinsky:
logP: 4.134
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 97
Number of rings: 2

     

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