COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK862058
Chemical Name: N-{2,2,2-trichloro-1-[({2-methyl-4-[(E)-(2-methylphenyl)diazenyl]phenyl}carbamothioyl)amino]ethyl}butanamide
Smiles: CCCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)Nc1ccc(cc1C)/N=N/c1ccccc1C

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Molecular Weight: 500.88
Empirical Formula: C21H24Cl3N5OS

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 6.879
Rotatable bonds: 4
H-donors: 3
H-acceptors: 1
PSA: 109
Number of rings: 2

     

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