COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562467
Chemical Name: 3-{3-[(4-bromophenyl)carbonyl]-4-hydroxy-1-[2-(morpholin-4-ium-4-yl)ethyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}phenolate
Smiles: [O-]c1cccc(c1)C1N(CC[NH+]2CCOCC2)C(=O)C(=C1C(=O)c1ccc(cc1)Br)O

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Molecular Weight: 487.35
Empirical Formula: C23H23BrN2O5

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 2.763
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 94
Number of rings: 4

     

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