COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK544859
Chemical Name: (3aS,6aS)-5-(3-fluorophenyl)-3-(quinolin-2-ylcarbonyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)C(=NN2)C(=O)c1ccc2c(n1)cccc2

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Molecular Weight: 388.36
Empirical Formula: C21H13FN4O3

Physical State: Dry powder
Available Amount: 273 mg

Lipinsky:
logP: 0.962
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 91
Number of rings: 5

     

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