COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK729198
Chemical Name: 2-[1-(4-benzylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(C(N1C(=O)c2c(C1=O)cccc2)Cc1ccccc1)N1CCN(CC1)Cc1ccccc1

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Saltdata: CI-
Molecular Weight: 453.54
Empirical Formula: C28H27N3O3

Physical State: Dry powder
Available Amount: 272 mg

Lipinsky:
logP: 4.944
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 60
Number of rings: 5

     

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