COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529960
Chemical Name: (2Z)-2-[(2-methyl-2H-chromen-3-yl)methylidene]-7-[(2-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CC1Oc2ccccc2C=C1/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCCCC1C)[O-]

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Molecular Weight: 417.5
Empirical Formula: C26H27NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.528
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 5

     

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