COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK638217
Chemical Name: methylN-1,3-benzothiazol-2(3H)-ylidene-3,3,3-trifluoro-2-{[(2-fluorophenyl)carbonyl]amino}alaninate
Smiles: COC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1F)/N=c/1\sc2c([nH]1)cccc2

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Molecular Weight: 427.38
Empirical Formula: C18H13F4N3O3S

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 7.553
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 105
Number of rings: 3

     

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