COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK599036
Chemical Name: methylN-1,3-benzothiazol-2(3H)-ylidene-3,3,3-trifluoro-2-(2-phenylhydrazinyl)alaninate
Smiles: COC(=O)C(C(F)(F)F)(/N=c/1\sc2c([nH]1)cccc2)NNc1ccccc1

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Molecular Weight: 396.39
Empirical Formula: C17H15F3N4O2S

Physical State: Dry powder
Available Amount: 250 mg

Lipinsky:
logP: 8.433
Rotatable bonds: 5
H-donors: 3
H-acceptors: 2
PSA: 100
Number of rings: 3

     

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