COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK034985
Chemical Name: 2-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylicacid
Smiles: C/C(=C\CN1CC23C(C1=O)C(C(O3)C=C2)C(=O)O)/CCC=C(C)C

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Molecular Weight: 331.41
Empirical Formula: C19H25NO4

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 3.946
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 66
Number of rings: 3

     

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