COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK838796
Chemical Name: methyl2-({(E)-2-cyano-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzoate
Smiles: N#C/C(=C\Nc1ccccc1C(=O)OC)/c1scc(n1)c1ccc(c(c1)OC)OC

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Molecular Weight: 421.48
Empirical Formula: C22H19N3O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.937
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 3

     

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