COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK626681
Chemical Name: (2Z)-2-(1-benzofuran-2-ylmethylidene)-7-{[bis(2-methylpropyl)ammonio]methyl}-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CC(C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cc3c(o1)cccc3)/C2=O)CC(C)C)C

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Molecular Weight: 419.52
Empirical Formula: C26H29NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.002
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 66
Number of rings: 4

     

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