COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK595864
Chemical Name: 3-(1-oxo-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}butan-2-yl)-1,2,3-benzotriazin-4(3H)-one
Smiles: CCC(n1nnc2c(c1=O)cccc2)C(=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F

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Molecular Weight: 445.44
Empirical Formula: C22H22F3N5O2

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 3.892
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 68
Number of rings: 4

     

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