COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK746887
Chemical Name: ethyl6-amino-4-(3-bromo-4-fluorophenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(OC(=C(C1c1ccc(c(c1)Br)F)C#N)N)c1ccccc1

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Molecular Weight: 443.27
Empirical Formula: C21H16BrFN2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.373
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 85
Number of rings: 3

     

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