COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL329658
Chemical Name: ethylN-[(3-chlorophenyl)carbonyl]-3,3,3-trifluoro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccc(c1)Cl)Nc1nnc(s1)C

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Molecular Weight: 422.82
Empirical Formula: C15H14ClF3N4O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.112
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 121
Number of rings: 2

     

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