SID78145

ID: ALA2000194

Chembl Id: CHEMBL2000194

Max Phase: Preclinical

Molecular Formula: C9H9O5Sb

Molecular Weight: 318.93

Molecule Type: Small molecule

Alternative Forms

1. Parent:

   

   ALA2000194

   ---

Molecule Features

Natural Product: No

Oral: No

Chemical Probe: No

Parenteral: No

Molecule Type: Small molecule

Topical: No

First In Class: No

Black Box: No

Chirality: No

Availability: No

Prodrug: No

Calculated Properties

Molecular Weight: 318.93

Molecular Weight (Monoisotopic): 317.9488

AlogP:

#Rotatable Bonds:

Polar Surface Area:

Molecular Species:

HBA:

HBD:

#RO5 Violations:

HBA (Lipinski):

HBD (Lipinski):

#RO5 Violations (Lipinski):

CX Acidic pKa:

CX Basic pKa:

CX LogP:

CX LogD:

Aromatic Rings:

Heavy Atoms:

QED Weighted:

Np Likeness Score:

References

1. PubChem BioAssay data set, 

2. Mak LH, Knott J, Scott KA, Scott C, Whyte GF, Ye Y, Mann DJ, Ces O, Stivers J, Woscholski R..  (2012)  Arylstibonic acids are potent and isoform-selective inhibitors of Cdc25a and Cdc25b phosphatases.,  20  (14): [PMID:22705189] [10.1016/j.bmc.2012.05.040]

3. Laev SS, Salakhutdinov NF, Lavrik OI..  (2017)  Inhibitors of nuclease and redox activity of apurinic/apyrimidinic endonuclease 1/redox effector factor 1 (APE1/Ref-1).,  25  (9): [PMID:28161249] [10.1016/j.bmc.2017.01.028]

Source

Source(2):

• Scientific Literature
• PubChem BioAssays