COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL154676
Chemical Name: 3-(1,3-benzodioxol-5-ylmethyl)-11-(3,5-dimethylphenyl)-2-ethyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCc1nc2c(c(=O)n1Cc1ccc3c(c1)OCO3)c1c(n2c2cc(C)cc(c2)C)nc2c(n1)cccc2

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Molecular Weight: 503.56
Empirical Formula: C30H25N5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.107
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 81
Number of rings: 7

     

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