COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK685000
Chemical Name: 1-oxo-2-(3,4,5-trimethoxybenzyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylicacid
Smiles: COc1cc(CN2CC34C(C2=O)C(C(O4)C=C3)C(=O)O)cc(c1OC)OC

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Molecular Weight: 375.38
Empirical Formula: C19H21NO7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.099
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 94
Number of rings: 4

     

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