COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473123
Chemical Name: (2E)-3-[5-bromo-2-(3-methylbutoxy)phenyl]-2-cyano-N-(1,3-thiazol-2-yl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(Br)ccc1OCCC(C)C)/C(=O)Nc1nccs1

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Molecular Weight: 420.33
Empirical Formula: C18H18BrN3O2S

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 5.615
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 103
Number of rings: 2

     

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