COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK819976
Chemical Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-hydroxy-5-[3-(pentyloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCCOc1cccc(c1)C1C(=C(C(=O)N1c1sc2c(n1)ccc(c2)OCC)O)C(=O)c1ccc2c(c1)OCCO2

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Molecular Weight: 600.69
Empirical Formula: C33H32N2O7S

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 7.79
Rotatable bonds: 11
H-donors: 1
H-acceptors: 7
PSA: 135
Number of rings: 6

     

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