COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL062504
Chemical Name: ethyl(2E)-4-oxo-4-{[(2,4,5-trichlorophenyl)carbamothioyl]amino}but-2-enoate
Smiles: CCOC(=O)/C=C/C(=O)NC(=S)Nc1cc(Cl)c(cc1Cl)Cl

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Molecular Weight: 381.67
Empirical Formula: C13H11Cl3N2O3S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 4.013
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 99
Number of rings: 1

     

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