COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK628513
Chemical Name: (2E)-2-[(1-ethyl-1H-indol-3-yl)methylidene]-7-[(4-methylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C[NH+]1CCC(CC1)C)[O-]

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Molecular Weight: 416.52
Empirical Formula: C26H28N2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.851
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 58
Number of rings: 5

     

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