COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL520412
Chemical Name: methyl4-{[(4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CC/C(=C/Cc1c(OC)c(C)c2c(c1O)C(=O)OC2)/C

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Molecular Weight: 453.49
Empirical Formula: C25H27NO7

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 4.999
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 111
Number of rings: 3

     

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