COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK863309
Chemical Name: 2-{1-[4-(2-hydroxyethyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-1H-isoindole-1,3(2H)-dione
Smiles: OCCN1CCN(CC1)C(=O)C(N1C(=O)c2c(C1=O)cccc2)Cc1ccccc1

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Saltdata: CI-
Molecular Weight: 407.47
Empirical Formula: C23H25N3O4

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.138
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 81
Number of rings: 4

     

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