TENOFOVIR

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: Parent
UNII: W4HFE001U5

Structure
InChI Key SGOIRFVFHAKUTI-ZCFIWIBFSA-N
Smile C[C@H](Cn1cnc2c(N)ncnc21)OCP(=O)(O)O
InChI
InChI=1S/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t6-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C9H14N5O4P
Molecular Weight 287.22
AlogP -0.05
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 5.0
Polar Surface Area 136.38
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 19.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR DNA polymerase/reverse transcriptase inhibitor PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- 380-380 3200 - -
Structural protein
242 - - - -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 18

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Severe Acute Respiratory Syndrome 3 D045169 ClinicalTrials
Infections 3 D007239 ClinicalTrials
HIV Infections 3 D015658 ClinicalTrials
Acquired Immunodeficiency Syndrome 3 D000163 ClinicalTrials
Carcinoma, Hepatocellular 3 D006528 ClinicalTrials
HIV Infections 3 D015658 ClinicalTrials
Hepatitis B, Chronic 3 D019694 ClinicalTrials
Hepatitis B, Chronic 3 D019694 ClinicalTrials
Hepatitis D 3 D003699 ClinicalTrials
Insulin Resistance 1 D007333 ClinicalTrials
Hepatitis C, Chronic 1 D019698 ClinicalTrials

Related Entries

MCS

Scaffolds

Mixture

Cross References

Resources Reference
CAS NUMBER 147127-20-6
ChEBI 63625
ChEMBL CHEMBL483
DrugBank DB14126
DrugCentral 2592
EPA CompTox DTXSID9040132
FDA SRS W4HFE001U5
Human Metabolome Database HMDB0014445
Guide to Pharmacology 10948
PDB TFO
PharmGKB PA10204
PubChem 21146529
SureChEMBL SCHEMBL39724
ZINC ZINC000001543475
CAS NUMBER 147127-20-6
ChEBI 63716
ChEMBL CHEMBL3989702
FDA SRS 99YXE507IL
Guide to Pharmacology 10948
PubChem 21146529
SureChEMBL SCHEMBL3133902
CONTENTS