COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL509788
Chemical Name: 3-{2-(4-bromophenyl)-1-[4-(dimethylamino)pyridinium-1-yl]-2-oxoethyl}-2-oxo-2H-chromen-4-olate
Smiles: Brc1ccc(cc1)C(=O)C(c1c(=O)oc2c(c1[O-])cccc2)[n+]1ccc(cc1)N(C)C

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Molecular Weight: 479.33
Empirical Formula: C24H19BrN2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.06
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 73
Number of rings: 4

     

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