COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL485005
Chemical Name: 5-(1,3-benzodioxol-5-yl)-4-[(4-bromophenyl)carbonyl]-3-hydroxy-1-(2-hydroxyethyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: OCCN1C(=O)C(=C(C1c1ccc2c(c1)OCO2)C(=O)c1ccc(cc1)Br)O

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Molecular Weight: 446.25
Empirical Formula: C20H16BrNO6

Physical State: Dry powder
Available Amount: 188 mg

Lipinsky:
logP: 2.973
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 96
Number of rings: 4

     

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