COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK563914
Chemical Name: 3-[(3E)-3-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]benzoicacid
Smiles: Cc1ccc(cc1)C1N(c2cccc(c2)C(=O)O)C(=O)C(=O)/C/1=C(\C=C\c1ccccc1)/O

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Molecular Weight: 439.47
Empirical Formula: C27H21NO5

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 4.754
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 94
Number of rings: 4

     

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