COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK818862
Chemical Name: 1-benzyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1c(OC)cc(cc1OC)C1C(=C(C(=O)N1Cc1ccccc1)O)C(=O)c1ccc2c(c1)OCCO2

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Molecular Weight: 517.54
Empirical Formula: C29H27NO8

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.198
Rotatable bonds: 6
H-donors: 1
H-acceptors: 8
PSA: 103
Number of rings: 5

     

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