COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK990491
Chemical Name: 11-(4-chloro-3-nitrophenyl)-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CC(CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)[N+](=O)[O-])Cl)C

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Molecular Weight: 462.9
Empirical Formula: C23H19ClN6O3

Physical State: Dry powder
Available Amount: 387 mg

Lipinsky:
logP: 4.677
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 109
Number of rings: 5

     

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