COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK634371
Chemical Name: ethyl(E)-N-1,3-benzothiazol-2(3H)-ylidene-2-{[(3-chlorophenyl)carbonyl]amino}-3,3,3-trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccc(c1)Cl)/N=c\1/sc2c([nH]1)cccc2

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Molecular Weight: 457.86
Empirical Formula: C19H15ClF3N3O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 9.301
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 105
Number of rings: 3

     

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