COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL438092
Chemical Name: 5-(1,3-benzodioxol-5-yl)-3-hydroxy-1-(2-hydroxyethyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: OCCN1C(c2ccc3c(c2)OCO3)C(=C(C1=O)O)C(=O)/C=C/c1ccccc1

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Molecular Weight: 393.4
Empirical Formula: C22H19NO6

Physical State: Dry powder
Available Amount: 296 mg

Lipinsky:
logP: 2.892
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 96
Number of rings: 4

     

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