COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK451097
Chemical Name: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)carbonyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylicacid
Smiles: OC(=O)C1C2CCC(C1C(=O)n1nc(c(c1C)Br)C)O2

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Molecular Weight: 343.18
Empirical Formula: C13H15BrN2O4

Physical State: Dry powder
Available Amount: 347 mg

Lipinsky:
logP: 2.052
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 81
Number of rings: 3

     

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