COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK403746
Chemical Name: methyl11-(3-bromo-5-ethoxy-4-methoxyphenyl)-3-methyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepine-2-carboxylate
Smiles: CCOc1cc(cc(c1OC)Br)C1Nc2ccccc2NC2=C1C(=O)C(C(C2)C)C(=O)OC

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Molecular Weight: 515.4
Empirical Formula: C25H27BrN2O5

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 3.888
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 85
Number of rings: 4

     

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