COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK865040
Chemical Name: ethyl4-{[(7-bromo-1-benzoxepin-4-yl)carbonyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C1=Cc2cc(Br)ccc2OC=C1

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Molecular Weight: 414.26
Empirical Formula: C20H16BrNO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.193
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 3

     

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