COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK020270
Chemical Name: methyl4-[(2-methyl-4-nitrophenyl)amino]-4-oxobutanoate
Smiles: COC(=O)CCC(=O)Nc1ccc(cc1C)[N+](=O)[O-]

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Molecular Weight: 266.25
Empirical Formula: C12H14N2O5

Physical State: Dry powder
Available Amount: 84 mg

Lipinsky:
logP: 2.389
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 1

     

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