COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045772
Chemical Name: 4-oxo-4-{[(2E)-3-phenylprop-2-en-1-yl]oxy}butanoicacid
Smiles: O=C(CCC(=O)O)OC/C=C/c1ccccc1

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Molecular Weight: 234.25
Empirical Formula: C13H14O4

Physical State: Dry powder
Available Amount: 396 mg

Lipinsky:
logP: 2.232
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 1

     

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