EcoDrugPlus


Synonyms	E-7337 E7337 Iomeprol Iomeron 300
Status
Molecule Category	Free-form
ATC	V08AB10
UNII	17E17JBP8L
EPA CompTox	DTXSID1049061

Synonyms

E-7337

E7337

Iomeprol

Iomeron 300

Status

Molecule Category

Free-form

ATC

V08AB10

UNII

17E17JBP8L

EPA CompTox

DTXSID1049061


InChI Key	NJKDOADNQSYQEV-UHFFFAOYSA-N
Smiles	CN(C(=O)CO)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I
InChI	InChI=1S/C17H22I3N3O8/c1-23(9(29)6-26)15-13(19)10(16(30)21-2-7(27)4-24)12(18)11(14(15)20)17(31)22-3-8(28)5-25/h7-8,24-28H,2-6H2,1H3,(H,21,30)(H,22,31)

InChI Key

NJKDOADNQSYQEV-UHFFFAOYSA-N

Smiles

CN(C(=O)CO)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I

InChI

InChI=1S/C17H22I3N3O8/c1-23(9(29)6-26)15-13(19)10(16(30)21-2-7(27)4-24)12(18)11(14(15)20)17(31)22-3-8(28)5-25/h7-8,24-28H,2-6H2,1H3,(H,21,30)(H,22,31)

Property Name	Value
Molecular Formula	C17H22I3N3O8
Molecular Weight	777.09
AlogP	-1.38
Hydrogen Bond Acceptor	8.0
Hydrogen Bond Donor	7.0
Number of Rotational Bond	10.0
Polar Surface Area	179.66
Molecular species	NEUTRAL
Aromatic Rings	1.0
Heavy Atoms	31.0

Property Name

Value

Molecular Formula

C17H22I3N3O8

Molecular Weight

777.09

AlogP

-1.38

Hydrogen Bond Acceptor

8.0

Hydrogen Bond Donor

7.0

Number of Rotational Bond

10.0

Polar Surface Area

179.66

Molecular species

NEUTRAL

Aromatic Rings

1.0

Heavy Atoms

31.0

Countries
Croatia
Czech Republic
Germany
Hungary
Romania
Slovenia

Countries

Croatia

Czech Republic

Germany

Hungary

Romania

Slovenia

Resources	Reference
ChEBI	31710
ChEMBL	CHEMBL2107214
DrugBank	DB11705
DrugCentral	1463
FDA SRS	17E17JBP8L
SureChEMBL	SCHEMBL26981

Resources

Reference

ChEBI

ChEMBL

DrugBank

DrugCentral

FDA SRS

SureChEMBL

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

IOMEPROL

Structure

Physicochemical Descriptors

Environmental Exposure

Cross References