COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK634730
Chemical Name: 11-(4-chloro-3-nitrophenyl)-3-cyclohexyl-2-ethyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCc1nc2n(c3ccc(c(c3)[N+](=O)[O-])Cl)c3c(c2c(=O)n1C1CCCCC1)nc1c(n3)cccc1

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Molecular Weight: 502.96
Empirical Formula: C26H23ClN6O3

Physical State: Dry powder
Available Amount: 295 mg

Lipinsky:
logP: 5.725
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 109
Number of rings: 6

     

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