COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK990241
Chemical Name: 2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(c(c1)OC)OC

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Molecular Weight: 489.62
Empirical Formula: C28H35N5O3

Physical State: Dry powder
Available Amount: 395 mg

Lipinsky:
logP: 6.283
Rotatable bonds: 12
H-donors: 3
H-acceptors: 3
PSA: 104
Number of rings: 4

     

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