COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL082342
Chemical Name: 3-(3-chlorobenzyl)-6-({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Smiles: Clc1cccc(c1)Cn1nnc2c1ncn(c2=O)Cc1onc(n1)c1cccc(c1)C(F)(F)F

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Molecular Weight: 487.83
Empirical Formula: C21H13ClF3N7O2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.79
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 102
Number of rings: 5

     

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