COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL563042
Chemical Name: ethyl(3aS,6R,7aR)-2-butyl-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Smiles: CCCCN1C[C@@]23[C@H](C1=O)C([C@@H](O3)C=C2)C(=O)OCC

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Molecular Weight: 279.34
Empirical Formula: C15H21NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.51
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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