COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK369543
Chemical Name: 2-{[(2,2,2-trichloro-1-{[(4-methylphenyl)carbonyl]amino}ethyl)carbamothioyl]amino}benzoicacid
Smiles: S=C(NC(C(Cl)(Cl)Cl)NC(=O)c1ccc(cc1)C)Nc1ccccc1C(=O)O

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Molecular Weight: 460.77
Empirical Formula: C18H16Cl3N3O3S

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 5.872
Rotatable bonds: 4
H-donors: 4
H-acceptors: 3
PSA: 122
Number of rings: 2

     

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