COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK622673
Chemical Name: (2Z)-2-(2,4-dichlorobenzylidene)-3-oxo-7-(piperidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Smiles: Clc1ccc(c(c1)Cl)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCCCC1)[O-]

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Molecular Weight: 404.29
Empirical Formula: C21H19Cl2NO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.421
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 53
Number of rings: 4

     

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