COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL178080
Chemical Name: 2-({4-[3-(trifluoromethyl)benzyl]piperazin-1-yl}methyl)-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CN2CCN(CC2)Cc2cccc(c2)C(F)(F)F)C(=O)c2c1cccc2

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Molecular Weight: 403.4
Empirical Formula: C21H20F3N3O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.312
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 43
Number of rings: 4

     

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