COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK843096
Chemical Name: 1-butyl-3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCN1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)c1ccc(cc1)OC

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Molecular Weight: 410.43
Empirical Formula: C22H22N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.196
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 112
Number of rings: 3

     

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