COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK312500
Chemical Name: [3-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]aceticacid
Smiles: OC(=O)CC12CC3CC(C1)CC(C2)(C3)n1nc(c(c1C)Cl)[N+](=O)[O-]

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Molecular Weight: 353.81
Empirical Formula: C16H20ClN3O4

Physical State: Dry powder
Available Amount: 5053 mg

Lipinsky:
logP: 3.224
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 100
Number of rings: 5

     

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