EcoDrugPlus


Synonyms	Abdnaz Radiosensitizer rrx-001 Rrx 001 Rrx-001
Status
Molecule Category	Free-form
UNII	7RPW6SU9SC

Synonyms

Abdnaz

Radiosensitizer rrx-001

Rrx 001

Rrx-001

Status

Molecule Category

Free-form

UNII

7RPW6SU9SC


InChI Key	JODKFOVZURLVTG-UHFFFAOYSA-N
Smiles	O=C(CBr)N1CC([N+](=O)[O-])([N+](=O)[O-])C1
InChI	InChI=1S/C5H6BrN3O5/c6-1-4(10)7-2-5(3-7,8(11)12)9(13)14/h1-3H2

InChI Key

JODKFOVZURLVTG-UHFFFAOYSA-N

Smiles

O=C(CBr)N1CC([N+](=O)[O-])([N+](=O)[O-])C1

InChI

InChI=1S/C5H6BrN3O5/c6-1-4(10)7-2-5(3-7,8(11)12)9(13)14/h1-3H2

Property Name	Value
Molecular Formula	C5H6BrN3O5
Molecular Weight	268.02
AlogP	-0.53
Hydrogen Bond Acceptor	5.0
Number of Rotational Bond	3.0
Polar Surface Area	106.59
Molecular species	NEUTRAL
Aromatic Rings	0.0
Heavy Atoms	14.0

Property Name

Value

Molecular Formula

C5H6BrN3O5

Molecular Weight

268.02

AlogP

-0.53

Hydrogen Bond Acceptor

5.0

Number of Rotational Bond

3.0

Polar Surface Area

106.59

Molecular species

NEUTRAL

Aromatic Rings

0.0

Heavy Atoms

14.0

Resources	Reference
ChEMBL	CHEMBL3526802
DrugBank	DB12060
FDA SRS	7RPW6SU9SC
PubChem	15950826
SureChEMBL	SCHEMBL2249018
ZINC	ZINC000034805177

Resources

Reference

ChEMBL

DrugBank

FDA SRS

PubChem

SureChEMBL

ZINC

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

RRX-001

Structure

Physicochemical Descriptors

Cross References