COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK986985
Chemical Name: butyl4-{[(1E)-3-(4-bromophenyl)-3-oxoprop-1-en-1-yl]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)N/C=C/C(=O)c1ccc(cc1)Br

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Molecular Weight: 402.29
Empirical Formula: C20H20BrNO3

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 5.859
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 55
Number of rings: 2

     

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