COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK550686
Chemical Name: tert-butyl(8R,8aS,11aR)-10-(4-nitrophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-8-carboxylate
Smiles: O=C([C@H]1[C@H]2C(=O)N(C(=O)[C@H]2C2N1N=Cc1c2cccc1)c1ccc(cc1)[N+](=O)[O-])OC(C)(C)C

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Molecular Weight: 462.46
Empirical Formula: C24H22N4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.454
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 125
Number of rings: 5

     

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