COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545585
Chemical Name: methyl3,3,3-trifluoro-2-[(4-methyl-1,3-benzothiazol-2-yl)amino]-N-[(4-methylphenyl)carbonyl]alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1)C)Nc1nc2c(s1)cccc2C

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Molecular Weight: 437.44
Empirical Formula: C20H18F3N3O3S

Physical State: Dry powder
Available Amount: 264 mg

Lipinsky:
logP: 8.707
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 108
Number of rings: 3

     

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