COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545249
Chemical Name: butyl4-[(8S,8aR,11aS)-9,11-dioxo-8-(phenylcarbonyl)-8a,9,11a,11b-tetrahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazin-10(11H)-yl]benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1C2c2ccccc2C=N1)C(=O)c1ccccc1

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Molecular Weight: 521.57
Empirical Formula: C31H27N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.47
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 96
Number of rings: 6

     

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