COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK849395
Chemical Name: (2Z)-7-{[bis(2-methoxyethyl)ammonio]methyl}-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccc(c1)[N+](=O)[O-])/C2=O)CCOC

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Molecular Weight: 428.44
Empirical Formula: C22H24N2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.01
Rotatable bonds: 9
H-donors: 1
H-acceptors: 7
PSA: 118
Number of rings: 3

     

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