COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052267
Chemical Name: methyl(4S)-6-amino-5-cyano-2-(2-methoxy-2-oxoethyl)-4-(2-nitrophenyl)-4H-pyran-3-carboxylate
Smiles: COC(=O)C1=C(CC(=O)OC)OC(=C([C@@H]1c1ccccc1[N+](=O)[O-])C#N)N

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Molecular Weight: 373.32
Empirical Formula: C17H15N3O7

Physical State: Dry powder
Available Amount: 481 mg

Lipinsky:
logP: 1.488
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 157
Number of rings: 2

     

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