COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK855756
Chemical Name: (2Z)-7-{[bis(2-methoxyethyl)ammonio]methyl}-4-methyl-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: COCC[NH+](Cc1c([O-])cc(c2c1O/C(=C\c1ccncc1)/C2=O)C)CCOC

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Molecular Weight: 398.46
Empirical Formula: C22H26N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.077
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 85
Number of rings: 3

     

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