COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037212
Chemical Name: 6-ethyl-3-(1-methyl-1H-benzimidazol-2-yl)-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-2-(propan-2-yl)-4H-chromen-7-olate
Smiles: CCc1cc2c(c(c1[O-])C[NH+]1CCN(CC1)C)oc(c(c2=O)c1nc2c(n1C)cccc2)C(C)C

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Molecular Weight: 474.6
Empirical Formula: C28H34N4O3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.775
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 74
Number of rings: 5

     

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