COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL388184
Chemical Name: 2-[4-chloro-3-(trifluoromethyl)phenyl]-4-(hydroxymethyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Smiles: OCC12C=CC(O1)C1C2C(=O)N(C1=O)c1ccc(c(c1)C(F)(F)F)Cl

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Molecular Weight: 373.72
Empirical Formula: C16H11ClF3NO4

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 2.12
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 66
Number of rings: 4

     

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