COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL476182
Chemical Name: methylN-[(4E)-6-(4,6-dimethoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]phenylalaninate
Smiles: COC(=O)C(Cc1ccccc1)NC(=O)CC/C(=C/Cc1c(OC)c(C)c2c(c1OC)C(=O)OC2)/C

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Molecular Weight: 495.57
Empirical Formula: C28H33NO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.856
Rotatable bonds: 11
H-donors: 1
H-acceptors: 7
PSA: 100
Number of rings: 3

     

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