COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK384235
Chemical Name: benzyl2-(4-chloro-3-fluorophenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Smiles: O=C(C1C2C=CC3(C1C(=O)N(C3)c1ccc(c(c1)F)Cl)O2)OCc1ccccc1

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Molecular Weight: 413.83
Empirical Formula: C22H17ClFNO4

Physical State: Dry powder
Available Amount: 524 mg

Lipinsky:
logP: 4.437
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 55
Number of rings: 5

     

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