COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551296
Chemical Name: (1'S,2'S,3R,3a'R)-2'-(1,3-benzodioxol-5-ylcarbonyl)-1'-(2,2-dimethylpropanoyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: O=C([C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C)c1ccc2c(c1)OCO2

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Molecular Weight: 520.58
Empirical Formula: C32H28N2O5

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 5.341
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 84
Number of rings: 7

     

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