COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL239770
Chemical Name: 11-(1,3-benzodioxol-5-ylmethyl)-2-methyl-3-(2-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1nc2c(c(=O)n1CCc1ccccc1)c1c(n2Cc2ccc3c(c2)OCO3)nc2c(n1)cccc2

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Molecular Weight: 489.53
Empirical Formula: C29H23N5O3

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 5.604
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 81
Number of rings: 7

     

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