COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK747531
Chemical Name: ethyl6-amino-4-(4-chloro-3-nitrophenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(OC(=C(C1c1ccc(c(c1)[N+](=O)[O-])Cl)C#N)N)c1ccccc1

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Molecular Weight: 425.83
Empirical Formula: C21H16ClN3O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.754
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 131
Number of rings: 3

     

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