COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL524938
Chemical Name: (3aS,6aS)-5-(2-methoxyphenyl)-3-(quinolin-2-ylcarbonyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Smiles: COc1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)C(=NN2)C(=O)c1ccc2c(n1)cccc2

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Molecular Weight: 400.39
Empirical Formula: C22H16N4O4

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 0.826
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 100
Number of rings: 5

     

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