COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL058229
Chemical Name: 4-hydroxy-3,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylate
Smiles: OC1CC(C)(C)Cc2c1c(C)c(o2)C(=O)[O-]

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Saltdata: K+
Molecular Weight: 223.25
Empirical Formula: C12H15O4

Physical State: Dry powder
Available Amount: 326 mg

Lipinsky:
logP: 1.964
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 73
Number of rings: 2

     

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