COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL390722
Chemical Name: {5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]methanone
Smiles: O=C(c1ccc(o1)Cn1nc(c(c1C)[N+](=O)[O-])C)N1CCN(CC1)C12CC3CC(C2)CC(C1)C3

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Molecular Weight: 467.57
Empirical Formula: C25H33N5O4

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 3.959
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 7

     

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