COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL520424
Chemical Name: (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]hex-4-enamide
Smiles: COc1c(C/C=C(/CCC(=O)/N=c\2/[nH]nc(s2)C)\C)c(O)c2c(c1C)COC2=O

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Molecular Weight: 417.49
Empirical Formula: C20H23N3O5S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.553
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 134
Number of rings: 3

     

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