COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK641705
Chemical Name: ethylN-(6-ethoxy-1,3-benzothiazol-2(3H)-ylidene)-2-[(ethoxycarbonyl)amino]-3,3,3-trifluoroalaninate
Smiles: CCOC(=O)NC(C(F)(F)F)(C(=O)OCC)/N=c\1/sc2c([nH]1)ccc(c2)OCC

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Molecular Weight: 435.42
Empirical Formula: C17H20F3N3O5S

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 8.601
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 123
Number of rings: 2

     

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