COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL473913
Chemical Name: (4E)-N-(3,5-dimethyl-1-propyl-1H-pyrazol-4-yl)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enamide
Smiles: CCCn1nc(c(c1C)NC(=O)CC/C(=C/Cc1c(O)c2C(=O)OCc2c(c1OC)C)/C)C

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Molecular Weight: 455.55
Empirical Formula: C25H33N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.662
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 102
Number of rings: 3

     

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