COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK710425
Chemical Name: methyl5-(3,4-dimethylphenyl)-6a-methyl-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: COC(=O)C1=NNC2(C1C(=O)N(C2=O)c1ccc(c(c1)C)C)C

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Molecular Weight: 315.33
Empirical Formula: C16H17N3O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.731
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 88
Number of rings: 3

     

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