COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL532111
Chemical Name: 8-{[(1-carboxy-2-phenylethyl)ammonio]methyl}-4-oxo-3-phenoxy-4H-chromen-7-olate
Smiles: [O-]c1ccc2c(c1C[NH2+]C(C(=O)O)Cc1ccccc1)occ(c2=O)Oc1ccccc1

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Molecular Weight: 431.44
Empirical Formula: C25H21NO6

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 4.608
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 112
Number of rings: 4

     

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