COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK553152
Chemical Name: butyl4-[(8R,8aS,11aR)-8-[(4-methoxyphenyl)carbonyl]-9,11-dioxo-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)c1ccc(cc1)OC

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Molecular Weight: 551.6
Empirical Formula: C32H29N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.545
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 105
Number of rings: 6

     

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