COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL253109
Chemical Name: (2E)-3-phenyl-N-(2,2,2-trichloro-1-{[(4-chlorophenyl)carbamothioyl]amino}ethyl)prop-2-enamide
Smiles: O=C(NC(C(Cl)(Cl)Cl)NC(=S)Nc1ccc(cc1)Cl)/C=C/c1ccccc1

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Molecular Weight: 463.21
Empirical Formula: C18H15Cl4N3OS

Physical State: Dry powder
Available Amount: 15 mg

Lipinsky:
logP: 6.196
Rotatable bonds: 3
H-donors: 3
H-acceptors: 1
PSA: 85
Number of rings: 2

     

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