COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK080551
Chemical Name: methyl3-nitro-5-[(4-phenylbutan-2-yl)carbamoyl]benzoate
Smiles: COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)NC(CCc1ccccc1)C

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Molecular Weight: 356.38
Empirical Formula: C19H20N2O5

Physical State: Dry powder
Available Amount: 550 mg

Lipinsky:
logP: 3.887
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 2

     

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