COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551426
Chemical Name: methyl5-(3,5-dimethylphenyl)-4,6-dioxo-1-(3-oxobutyl)-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Smiles: COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cc(C)cc(c1)C)CCC(=O)C

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Molecular Weight: 371.39
Empirical Formula: C19H21N3O5

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 0.118
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 96
Number of rings: 3

     

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