COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK034700
Chemical Name: 2-{1-[4-(2-hydroxyethyl)piperazin-1-yl]-1-oxopropan-2-yl}-1H-isoindole-1,3(2H)-dione
Smiles: OCCN1CCN(CC1)C(=O)C(N1C(=O)c2c(C1=O)cccc2)C

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Saltdata: HCl
Molecular Weight: 331.37
Empirical Formula: C17H21N3O4

Physical State: Dry powder
Available Amount: 376 mg

Lipinsky:
logP: 1.177
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 81
Number of rings: 3

     

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