COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK878564
Chemical Name: 2-methylpropyl4-({(E)-2-cyano-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Smiles: N#C/C(=C\Nc1ccc(cc1)C(=O)OCC(C)C)/c1scc(n1)c1ccc(c(c1)OC)OC

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Molecular Weight: 463.56
Empirical Formula: C25H25N3O4S

Physical State: Dry powder
Available Amount: 113 mg

Lipinsky:
logP: 5.66
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 3

     

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