COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551838
Chemical Name: tert-butyl(8R,8aS,11aR)-10-(4-fluorophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-8-carboxylate
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H](N1C2c2ccccc2C=N1)C(=O)OC(C)(C)C

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Molecular Weight: 435.45
Empirical Formula: C24H22FN3O4

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 3.776
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 79
Number of rings: 5

     

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