COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL237180
Chemical Name: 4-{[(4-hydroxy-3,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-2-yl)carbonyl]amino}benzoicacid
Smiles: O=C(c1oc2c(c1C)C(O)CC(C2)(C)C)Nc1ccc(cc1)C(=O)O

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Molecular Weight: 343.38
Empirical Formula: C19H21NO5

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 3.813
Rotatable bonds: 3
H-donors: 3
H-acceptors: 5
PSA: 99
Number of rings: 3

     

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