COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL025941
Chemical Name: (2E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-{[4-chloro-2-(trifluoromethyl)phenyl]amino}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C(F)(F)F)Cl)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

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Molecular Weight: 552.76
Empirical Formula: C22H10BrClF3N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.916
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 103
Number of rings: 4

     

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