COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545112
Chemical Name: (3aR,4S,9aR,9bS)-4-[(3-bromo-4-methoxyphenyl)carbonyl]-2-(2,4-dichlorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: COc1ccc(cc1Br)C(=O)[C@H]1N2C=CC(=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Cl)Cl)C(=O)c1ccccc1

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Molecular Weight: 652.33
Empirical Formula: C31H21BrCl2N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.348
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 83
Number of rings: 6

     

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