COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK990569
Chemical Name: 11-(4-chloro-3-nitrophenyl)-3-(3-ethoxypropyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCOCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 492.92
Empirical Formula: C24H21ClN6O4

Physical State: Dry powder
Available Amount: 385 mg

Lipinsky:
logP: 3.892
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 118
Number of rings: 5

     

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