COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK550012
Chemical Name: 3-(1,3-benzodioxol-5-ylmethyl)-11-(3,5-dimethylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1cc(C)cc(c1)n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)Cc1ccc2c(c1)OCO2

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Molecular Weight: 475.51
Empirical Formula: C28H21N5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.177
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 81
Number of rings: 7

     

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