COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK681727
Chemical Name: methyl6,8-dibromo-4-[1-(4-chlorophenyl)-1-oxobutan-2-yl]-2-oxo-3,4-dihydro-2H-chromene-3-carboxylate
Smiles: COC(=O)C1C(=O)Oc2c(C1C(C(=O)c1ccc(cc1)Cl)CC)cc(cc2Br)Br

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Molecular Weight: 544.62
Empirical Formula: C21H17Br2ClO5

Available Amount: 0 mg

Lipinsky:
logP: 6.202
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 69
Number of rings: 3

     

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