TELRATOLIMOD

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Synonyms
Status
Molecule Category Free-form
UNII 16598XQ2BT

Structure

InChI Key RRTPWQXEERTRRK-UHFFFAOYSA-N
Smiles CCCCCCCCCCCCCCCCCC(=O)NCCCCOn1c(CCCC)nc2c(N)nc3ccccc3c21
InChI
InChI=1S/C36H59N5O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-27-33(42)38-28-22-23-29-43-41-32(26-6-4-2)40-34-35(41)30-24-20-21-25-31(30)39-36(34)37/h20-21,24-25H,3-19,22-23,26-29H2,1-2H3,(H2,37,39)(H,38,42)

Physicochemical Descriptors

Property Name Value
Molecular Formula C36H59N5O2
Molecular Weight 593.9
AlogP 9.1
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 25.0
Polar Surface Area 95.06
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 43.0

Pharmacology

Mechanism of Action Action Reference
Toll-like receptor 7 agonist AGONIST PubMed

Target Conservation

Protein: Toll-like receptor 8
Description: Toll-like receptor 8
Organism : Homo sapiens
Q9NR97 ENSG00000101916
Protein: Toll-like receptor 7
Description: Toll-like receptor 7
Organism : Homo sapiens
Q9NYK1 ENSG00000196664

Cross References

Resources Reference
ChEMBL CHEMBL4297631
FDA SRS 16598XQ2BT
PubChem 56833311
SureChEMBL SCHEMBL671176
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