COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK043588
Chemical Name: methyl6-amino-4-(4-bromophenyl)-5-cyano-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate
Smiles: COC(=O)C1=C(CC(=O)OC)OC(=C(C1c1ccc(cc1)Br)C#N)N

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Molecular Weight: 407.22
Empirical Formula: C17H15BrN2O5

Physical State: Dry powder
Available Amount: 487 mg

Lipinsky:
logP: 2.529
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 111
Number of rings: 2

     

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