COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK731462
Chemical Name: ethyl2-{[(3-bromophenoxy)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)COc2cccc(c2)Br)sc2c1CCCCC2

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Molecular Weight: 452.37
Empirical Formula: C20H22BrNO4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.952
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 92
Number of rings: 3

     

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