COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK733024
Chemical Name: 1-{[3-(2-chlorophenyl)-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]methyl}piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)Cn1nc(n(c1=S)c1ccccc1)c1ccccc1Cl

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Molecular Weight: 427.96
Empirical Formula: C21H22ClN5OS

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 1.969
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 97
Number of rings: 4

     

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