COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL473304
Chemical Name: (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)hex-4-enamide
Smiles: CCCc1nnc(s1)NC(=O)CC/C(=C/Cc1c(O)c2C(=O)OCc2c(c1OC)C)/C

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Molecular Weight: 445.54
Empirical Formula: C22H27N3O5S

Available Amount: 0 mg

Lipinsky:
logP: 4.063
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 138
Number of rings: 3

     

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