COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK041298
Chemical Name: 1-oxo-2-[(2E)-3-phenylprop-2-en-1-yl]-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylicacid
Smiles: OC(=O)C1C2C=CC3(C1C(=O)N(C3)C/C=C/c1ccccc1)O2

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Molecular Weight: 311.34
Empirical Formula: C18H17NO4

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 2.389
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 66
Number of rings: 4

     

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