COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL032879
Chemical Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-methyl-11-(4-phenoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1nc2n(c3ccc(cc3)Oc3ccccc3)c3c(c2c(=O)n1Cc1ccc2c(c1)OCO2)nc1c(n3)cccc1

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Molecular Weight: 553.58
Empirical Formula: C33H23N5O4

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 6.647
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 91
Number of rings: 8

     

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