COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK666100
Chemical Name: [2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}methanone
Smiles: CC(=CC1C(C1(C)C)C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)[N+](=O)[O-])C

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Molecular Weight: 451.57
Empirical Formula: C25H33N5O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.835
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 87
Number of rings: 4

     

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