COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541816
Chemical Name: 5-methoxy-2-[(2E)-3-(thiophen-2-yl)prop-2-enoyl]phenyl4-bromobenzoate
Smiles: COc1ccc(c(c1)OC(=O)c1ccc(cc1)Br)C(=O)/C=C/c1cccs1

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Molecular Weight: 443.32
Empirical Formula: C21H15BrO4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 6.505
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 80
Number of rings: 3

     

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