COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL099490
Chemical Name: 3-(4-fluorophenyl)-7-hydroxy-8-{[(3-hydroxypropyl)amino]methyl}-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: OCCCNCc1c(O)ccc2c1oc(c(c2=O)c1ccc(cc1)F)C(F)(F)F

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Molecular Weight: 411.35
Empirical Formula: C20H17F4NO4

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.887
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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