COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK524818
Chemical Name: ethyl6-bromo-4-hydroxy-5-methoxy-2-methyl-7-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1c(O)c(OC)c(c2CN1CCN(CC1)C)Br

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Saltdata: 2 HCl
Molecular Weight: 441.32
Empirical Formula: C19H25BrN2O5

Physical State: Dry powder
Available Amount: 211 mg

Lipinsky:
logP: 2.259
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 75
Number of rings: 3

     

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