COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK844432
Chemical Name: dimethyl5-({(Z)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzene-1,3-dicarboxylate
Smiles: N#C/C(=C/Nc1cc(cc(c1)C(=O)OC)C(=O)OC)/c1scc(n1)c1cccc(c1)Br

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Molecular Weight: 498.36
Empirical Formula: C22H16BrN3O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.96
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 129
Number of rings: 3

     

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