COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK714364
Chemical Name: 11-[2-(3,4-dimethoxyphenyl)ethyl]-2-ethyl-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccc(cc1OC)CCn1c2nc3ccccc3nc2c2c1nc(CC)n(c2=O)CCC(C)C

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Molecular Weight: 499.61
Empirical Formula: C29H33N5O3

Physical State: Dry powder
Available Amount: 485 mg

Lipinsky:
logP: 6.197
Rotatable bonds: 9
H-donors: 0
H-acceptors: 3
PSA: 81
Number of rings: 5

     

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