COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK580412
Chemical Name: 4-{(3Z)-3-[(2E)-3,7-dimethylocta-2,6-dien-1-ylidene]-2,5-dioxopyrrolidin-1-yl}phenylacetate
Smiles: C/C(=C\C=C/1\CC(=O)N(C1=O)c1ccc(cc1)OC(=O)C)/CCC=C(C)C

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Molecular Weight: 367.44
Empirical Formula: C22H25NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.696
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 63
Number of rings: 2

     

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