COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK819982
Chemical Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-hydroxy-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(C)C)C(=C(C1=O)O)C(=O)c1ccc2c(c1)OCCO2

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Molecular Weight: 556.64
Empirical Formula: C31H28N2O6S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 7.088
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 126
Number of rings: 6

     

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