COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546341
Chemical Name: (3aS,6R,7aR)-3-(2-methylprop-2-en-1-yl)-1-oxo-2-(2-phenylethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylicacid
Smiles: CC(=C)CC1N(CCc2ccccc2)C(=O)[C@H]2[C@]31C=C[C@H](O3)C2C(=O)O

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Molecular Weight: 353.42
Empirical Formula: C21H23NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.98
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 66
Number of rings: 4

     

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