COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK662446
Chemical Name: 1-(4-nitrophenyl)-4-[3-(2,6,6-trimethyltetrahydro-2H-pyran-2-yl)prop-2-yn-1-yl]piperazine
Smiles: CC1(CCCC(O1)(C)C)C#CCN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 371.48
Empirical Formula: C21H29N3O3

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 4.899
Rotatable bonds: 0
H-donors: 0
H-acceptors: 3
PSA: 61
Number of rings: 3

     

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