COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK990643
Chemical Name: ethyl4-(3-hexyl-2-methyl-4-oxo-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl)benzoate
Smiles: CCCCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)C(=O)OCC

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Molecular Weight: 483.57
Empirical Formula: C28H29N5O3

Physical State: Dry powder
Available Amount: 430 mg

Lipinsky:
logP: 6.183
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 89
Number of rings: 5

     

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