COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL001123
Chemical Name: methyl4-hydroxy-2-oxo-6-phenylcyclohex-3-ene-1-carboxylate
Smiles: COC(=O)C1C(=O)C=C(CC1c1ccccc1)O

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Molecular Weight: 246.26
Empirical Formula: C14H14O4

Physical State: Dry powder
Available Amount: 3223 mg

Lipinsky:
logP: 1.925
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 2

     

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