COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL520422
Chemical Name: (4E)-N-[2-(cyclohex-1-en-1-yl)ethyl]-6-(4,6-dimethoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enamide
Smiles: COc1c(C/C=C(/CCC(=O)NCCC2=CCCCC2)\C)c(OC)c2c(c1C)COC2=O

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Molecular Weight: 441.57
Empirical Formula: C26H35NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.651
Rotatable bonds: 10
H-donors: 1
H-acceptors: 5
PSA: 73
Number of rings: 3

     

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