COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL233094
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-fluorophenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: COc1cc(CCNC(=O)C2C3C=CC4(C2C(=O)N(C4)c2ccccc2F)O3)ccc1OC

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Molecular Weight: 452.48
Empirical Formula: C25H25FN2O5

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 2.703
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 77
Number of rings: 5

     

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