COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL004088
Chemical Name: 2-(4-bromophenyl)-3,3,5-trimethyl-6-oxo-3,6-dihydro-2H-pyran-4-yl4-chlorobenzenesulfonate
Smiles: Clc1ccc(cc1)S(=O)(=O)OC1=C(C)C(=O)OC(C1(C)C)c1ccc(cc1)Br

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Molecular Weight: 485.78
Empirical Formula: C20H18BrClO5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.983
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 78
Number of rings: 3

     

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