COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK626015
Chemical Name: 8-({[2-(4-fluorophenyl)ethyl]ammonio}methyl)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-olate
Smiles: COc1ccc(cc1)c1cc(=O)oc2c1ccc(c2C[NH2+]CCc1ccc(cc1)F)[O-]

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Saltdata: HCl
Molecular Weight: 419.45
Empirical Formula: C25H22FNO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.331
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 75
Number of rings: 4

     

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