COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149421
Chemical Name: dimethyl2-({(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]ethylidene}amino)benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(c(c1)/N=C(/c1c(C)nn(c1O)c1nc2c(s1)cccc2)\C)C(=O)OC

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Molecular Weight: 464.5
Empirical Formula: C23H20N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.555
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 144
Number of rings: 4

     

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