General
Preferred name
IOPANOIC ACID
Synonyms
IOPANIC ACID ()
Acidum iopanoicum, Iodopanoic acid ()
Jopagnost ()
Cholevid ()
Choladine ()
Cistobil ()
NSC-41706 ()
Acidum iopanoicum ()
Iopagnost ()
Bilijodon ()
Colepax ()
Iopanoate ()
Telepaque ()
Copanoic ()
Jopanoic Acid ()
Iodopanoic acid ()
P&D ID
PD000806
CAS
96-83-3
Tags
natural product
drug
available
Approved by
FDA
First approval
1951
Drug Status
approved
withdrawn
Max Phase
Phase 4
Drug indication
Diagnostic Aid (radiopaque medium)
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
13
ChEMBL Approved Drugs
ChEMBL Drugs
DrugBank
DrugBank Approved Drugs
DrugCentral
DrugCentral Approved Drugs
MedChem Express Bioactive Compound Library
NPC Screening Collection
Prestwick Chemical Library
ReFrame library
Selleckchem Bioactive Compound Library
The Spectrum Collection
Withdrawn 2.0
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
29
Properties
(calculated by RDKit )
Molecular Weight
570.8
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
4
Ring Count
1
Aromatic Ring Count
1
cLogP
3.74
TPSA
63.32
Fraction CSP3
0.36
Chiral centers
1.0
Largest ring
6.0
QED
0.43
QED
0.43
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
ATC
V08AC06
Toxicity type
NULL
Source data
