COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK394172
Chemical Name: (4Z)-4-({[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]amino}methylidene)-5-methyl-2-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)phenyl]-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C\Nc1c(C)nn(c1C)c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)C12CC3CC(C2)CC(C1)C3

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Molecular Weight: 550.66
Empirical Formula: C32H34N6O3

Physical State: Dry powder
Available Amount: 235 mg

Lipinsky:
logP: 6.947
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 108
Number of rings: 8

     

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