COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK019122
Chemical Name: 2-(3-bromo-4-methoxyphenyl)-2-oxoethyl4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoate
Smiles: COc1ccc(cc1Br)C(=O)COC(=O)CCC(=O)c1ccc2c(c1)OCCO2

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Molecular Weight: 463.28
Empirical Formula: C21H19BrO7

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 4.207
Rotatable bonds: 9
H-donors: 0
H-acceptors: 7
PSA: 88
Number of rings: 3

     

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