COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK625398
Chemical Name: (2E)-2-[(1-methyl-1H-indol-3-yl)methylidene]-7-[(2-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: O=C1/C(=C\c2cn(c3c2cccc3)C)/Oc2c1ccc(c2C[NH+]1CCCCC1C)[O-]

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Molecular Weight: 402.49
Empirical Formula: C25H26N2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.32
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 58
Number of rings: 5

     

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