COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL438686
Chemical Name: (2E)-3-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]phenyl}-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)Oc1nc(Cl)ncc1F)/C(=O)Nc1ccc(cc1C)C

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Molecular Weight: 422.85
Empirical Formula: C22H16ClFN4O2

Physical State: Dry powder
Available Amount: 238 mg

Lipinsky:
logP: 5.587
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 87
Number of rings: 3

     

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