COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK384170
Chemical Name: 2-butyl-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylicacid
Smiles: CCCCN1CC23C(C1=O)C(C(O2)C=C3)C(=O)O

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Molecular Weight: 251.28
Empirical Formula: C13H17NO4

Physical State: Dry powder
Available Amount: 484 mg

Lipinsky:
logP: 1.555
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 66
Number of rings: 3

     

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