COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK902459
Chemical Name: methyl3-{[(1E)-3-(4-bromophenyl)-3-oxoprop-1-en-1-yl]amino}-4,5-diethoxybenzoate
Smiles: CCOc1c(N/C=C/C(=O)c2ccc(cc2)Br)cc(cc1OCC)C(=O)OC

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Molecular Weight: 448.31
Empirical Formula: C21H22BrNO5

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 5.437
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 73
Number of rings: 2

     

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