COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK555387
Chemical Name: 4-{[(8R,8aR,11aS,11bS)-10-(2-chlorophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinolin-8-yl]carbonyl}phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@@H]1N2C=Cc3c([C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1Cl)cccc3

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Molecular Weight: 512.95
Empirical Formula: C29H21ClN2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.818
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 83
Number of rings: 6

     

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