COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK990002
Chemical Name: nonyl2-amino-1-(1,3-benzodioxol-5-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCCCCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc2c(c1)OCO2

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Molecular Weight: 488.59
Empirical Formula: C28H32N4O4

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 8.454
Rotatable bonds: 12
H-donors: 2
H-acceptors: 4
PSA: 101
Number of rings: 5

     

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