Details of the Drug

General Information of Drug (ID: DMAJ9ZD)

Drug Name
Phosphonate
Synonyms Fitofosine; Antitumor, InflaZyme
Indication
Disease Entry ICD 11 Status REF
leukaemia 2A60-2B33 Terminated [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 78.972
Logarithm of the Partition Coefficient (xlogp) -1.8
Rotatable Bond Count (rotbonds) 0
Hydrogen Bond Donor Count (hbonddonor) 0
Hydrogen Bond Acceptor Count (hbondacc) 3
Chemical Identifiers
Formula
O3P-
Canonical SMILES
[O-]P(=O)=O
InChI
InChI=1S/HO3P/c1-4(2)3/h(H,1,2,3)/p-1
InChIKey
UEZVMMHDMIWARA-UHFFFAOYSA-M
Cross-matching ID
PubChem CID
6326969
ChEBI ID
CHEBI:8154
CAS Number
60118-28-7
TTD ID
D01NNL

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Phospholipase C (PLC) TT1UZQH NOUNIPROTAC Inhibitor [2]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

References

1 Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800004584)
2 Inhibition of phosphatidylinositol-specific phospholipase C by phosphonate substrate analogues. Biochim Biophys Acta. 1990 Feb 23;1042(3):410-2.