COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK265986
Chemical Name: 2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl4-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-4-oxobutanoate
Smiles: CCOc1ccc2c(c1)sc(n2)NC(=O)CCC(=O)OCC(=O)Nc1ccc(c(c1)Cl)C

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Molecular Weight: 475.95
Empirical Formula: C22H22ClN3O5S

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 4.747
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 134
Number of rings: 3

     

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