COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK821301
Chemical Name: 4-[({2,2,2-trichloro-1-[(phenoxyacetyl)amino]ethyl}carbamothioyl)amino]benzoicacid
Smiles: S=C(Nc1ccc(cc1)C(=O)O)NC(C(Cl)(Cl)Cl)NC(=O)COc1ccccc1

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Molecular Weight: 476.77
Empirical Formula: C18H16Cl3N3O4S

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 5.077
Rotatable bonds: 5
H-donors: 4
H-acceptors: 4
PSA: 131
Number of rings: 2

     

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