COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382572
Chemical Name: 5-(4-bromo-3-heptadecyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)-2-phenoxybenzenesulfonicacid
Smiles: CCCCCCCCCCCCCCCCCC1=NN(C(=O)C1Br)c1ccc(c(c1)S(=O)(=O)O)Oc1ccccc1

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Molecular Weight: 649.69
Empirical Formula: C32H45BrN2O5S

Physical State: Dry powder
Available Amount: 486 mg

Lipinsky:
logP: 9.939
Rotatable bonds: 19
H-donors: 1
H-acceptors: 5
PSA: 104
Number of rings: 3

     

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