COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK553389
Chemical Name: (8R,8aS,11aR)-10-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-(2,2-dimethylpropanoyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione
Smiles: O=C1N(c2ccc3c(c2)OCCO3)C(=O)[C@@H]2[C@H]1[C@@H](N1C2c2ccccc2C=N1)C(=O)C(C)(C)C

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Molecular Weight: 459.5
Empirical Formula: C26H25N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.128
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 88
Number of rings: 6

     

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