COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK053555
Chemical Name: methyl4-[(2-nitrophenyl)amino]-4-oxobutanoate
Smiles: COC(=O)CCC(=O)Nc1ccccc1[N+](=O)[O-]

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Molecular Weight: 252.23
Empirical Formula: C11H12N2O5

Physical State: Dry powder
Available Amount: 448 mg

Lipinsky:
logP: 1.269
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 1

     

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