COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK172432
Chemical Name: 1-{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone
Smiles: O=C(N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)[N+](=O)[O-])CC12CC3CC(C2)CC(C1)C3

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Molecular Weight: 477.61
Empirical Formula: C27H35N5O3

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 6.153
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 87
Number of rings: 7

     

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