COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL412480
Chemical Name: 2-[3-(octadecanoylamino)-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]-5-phenoxybenzenesulfonicacid
Smiles: CCCCCCCCCCCCCCCCCC(=O)NC1=NN(C(=O)C1)c1ccc(cc1S(=O)(=O)O)Oc1ccccc1

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Molecular Weight: 613.82
Empirical Formula: C33H47N3O6S

Physical State: Dry powder
Available Amount: 255 mg

Lipinsky:
logP: 9.058
Rotatable bonds: 19
H-donors: 2
H-acceptors: 6
PSA: 133
Number of rings: 3

     

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