COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL520361
Chemical Name: (4E)-N-[(2Z)-3,4,5,6,7,8-hexahydro-2H-cyclohepta[d][1,3]thiazol-2-ylidene]-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enamide
Smiles: COc1c(C/C=C(/CCC(=O)/N=c/2\sc3c([nH]2)CCCCC3)\C)c(O)c2c(c1C)COC2=O

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Molecular Weight: 470.59
Empirical Formula: C25H30N2O5S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 5.889
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 122
Number of rings: 4

     

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