COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL321142
Chemical Name: 2-[4-(4-cyclohexylpiperazin-1-yl)but-2-yn-1-yl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CC#CCN2CCN(CC2)C2CCCCC2)C(=O)c2c1cccc2

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Saltdata: 2 HCl
Molecular Weight: 365.48
Empirical Formula: C22H27N3O2

Available Amount: 0 mg

Lipinsky:
logP: 3.726
Rotatable bonds: 0
H-donors: 0
H-acceptors: 2
PSA: 43
Number of rings: 4

     

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