COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL033335
Chemical Name: (2Z)-7-(azepan-1-ylmethyl)-6-hydroxy-2-(2,4,5-trimethoxybenzylidene)-1-benzofuran-3(2H)-one
Smiles: COc1cc(OC)c(cc1/C=C/1\Oc2c(C1=O)ccc(c2CN1CCCCCC1)O)OC

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Molecular Weight: 439.51
Empirical Formula: C25H29NO6

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.833
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 77
Number of rings: 4

     

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