COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528988
Chemical Name: 8-methoxy-8'-[(3-methylpiperidinium-1-yl)methyl]-2,2'-dioxo-2H,2'H-3,4'-bichromen-7'-olate
Smiles: COc1cccc2c1oc(=O)c(c2)c1cc(=O)oc2c1ccc(c2C[NH+]1CCCC(C1)C)[O-]

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Molecular Weight: 447.49
Empirical Formula: C26H25NO6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.375
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 89
Number of rings: 5

     

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