COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL015928
Chemical Name: ethyl(2E)-5-amino-2-(3-bromobenzylidene)-7-(3-bromophenyl)-3-oxo-6-(phenylsulfonyl)-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Smiles: CCOC(=O)C1=c2s/c(=C/c3cccc(c3)Br)/c(=O)n2C(=C(C1c1cccc(c1)Br)S(=O)(=O)c1ccccc1)N

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Molecular Weight: 702.44
Empirical Formula: C29H22Br2N2O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.945
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 140
Number of rings: 5

     

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