COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808753
Chemical Name: 3-methyl-N-(2,2,2-trichloro-1-{[(2,5-dimethylphenyl)carbamothioyl]amino}ethyl)butanamide
Smiles: CC(CC(=O)NC(C(Cl)(Cl)Cl)NC(=S)Nc1cc(C)ccc1C)C

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Molecular Weight: 410.79
Empirical Formula: C16H22Cl3N3OS

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 5.036
Rotatable bonds: 4
H-donors: 3
H-acceptors: 1
PSA: 85
Number of rings: 1

     

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