COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK922975
Chemical Name: 3-(4-bromophenyl)-7-(3,3-dimethyl-2-oxobutoxy)-2-methyl-4H-chromen-4-one
Smiles: Brc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)C(C)(C)C

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Molecular Weight: 429.31
Empirical Formula: C22H21BrO4

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 5.105
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 52
Number of rings: 3

     

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