COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL361567
Chemical Name: methyl[2,9-bis(4-methylphenyl)-1,3,4-trioxodecahydro-3bH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]pyrazin-3b-yl]acetate
Smiles: COC(=O)CC12C(=O)NCCN2C(C2C1C(=O)N(C2=O)c1ccc(cc1)C)c1ccc(cc1)C

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Molecular Weight: 461.52
Empirical Formula: C26H27N3O5

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 2.896
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 96
Number of rings: 5

     

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