COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000018
Chemical Name: 3- chloro- 4- (3- methyl- 5- oxo- 4,5- dihydro- 1H- pyrazol- 1- yl)benzenesulfonicacid
Smiles: CC1=NN(C(=O)C1)c1ccc(cc1Cl)S(=O)(=O)O

Download SD file Download MOL file View 3D-structure Show MSDS

Molecular Weight: 288.71
Empirical Formula: C10H9ClN2O4S

Physical State: Dry powder
Available Amount: 27548 mg

Lipinsky:
logP: -0.348
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 2

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