COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK819411
Chemical Name: 5-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-1-(2-methoxyethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COCCN1C(=O)C(=C(C1c1cc(Br)c(c(c1)OC)O)C(=O)c1ccc2c(c1)OCCO2)O

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Molecular Weight: 520.33
Empirical Formula: C23H22BrNO8

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 3.052
Rotatable bonds: 9
H-donors: 2
H-acceptors: 8
PSA: 114
Number of rings: 4

     

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