COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK765163
Chemical Name: 1-(4-{4-[(2-chloro-5,6-difluoro-3-methylphenyl)carbonyl]piperazin-1-yl}-3-fluorophenyl)butan-1-one
Smiles: CCCC(=O)c1ccc(c(c1)F)N1CCN(CC1)C(=O)c1c(Cl)c(C)cc(c1F)F

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Molecular Weight: 438.88
Empirical Formula: C22H22ClF3N2O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.75
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 40
Number of rings: 3

     

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