COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK528775
Chemical Name: (2E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-[(3-butoxyphenyl)amino]prop-2-enenitrile
Smiles: CCCCOc1cccc(c1)N/C=C(/c1scc(n1)c1cc2cc(Br)ccc2oc1=O)\C#N

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Molecular Weight: 522.42
Empirical Formula: C25H20BrN3O3S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 6.393
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 4

     

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