COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL007891
Chemical Name: (2E)-4-oxo-4-phenylbut-2-enoicacid
Smiles: O=C(c1ccccc1)/C=C/C(=O)O

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Molecular Weight: 176.17
Empirical Formula: C10H8O3

Physical State: Dry powder
Available Amount: 11981 mg

Lipinsky:
logP: 1.593
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 54
Number of rings: 1

     

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