EcoDrugPlus


Synonyms	Azimilide dihydrochloride Azimilide hydrochloride NE-10064
Status
Molecule Category	Salt-form
UNII	6E6VJP68KR

Synonyms

Azimilide dihydrochloride

Azimilide hydrochloride

NE-10064

Status

Molecule Category

Salt-form

UNII

6E6VJP68KR


InChI Key	HHPSICLSNHCSNZ-BYEGLACWSA-N
Smiles	CN1CCN(CCCCN2C(=O)CN(/N=C/c3ccc(-c4ccc(Cl)cc4)o3)C2=O)CC1.Cl.Cl
InChI	InChI=1S/C23H28ClN5O3.2ClH/c1-26-12-14-27(15-13-26)10-2-3-11-28-22(30)17-29(23(28)31)25-16-20-8-9-21(32-20)18-4-6-19(24)7-5-18;;/h4-9,16H,2-3,10-15,17H2,1H3;2*1H/b25-16+;;

InChI Key

HHPSICLSNHCSNZ-BYEGLACWSA-N

Smiles

CN1CCN(CCCCN2C(=O)CN(/N=C/c3ccc(-c4ccc(Cl)cc4)o3)C2=O)CC1.Cl.Cl

InChI

InChI=1S/C23H28ClN5O3.2ClH/c1-26-12-14-27(15-13-26)10-2-3-11-28-22(30)17-29(23(28)31)25-16-20-8-9-21(32-20)18-4-6-19(24)7-5-18;;/h4-9,16H,2-3,10-15,17H2,1H3;2*1H/b25-16+;;

Property Name	Value
Molecular Formula	C23H30Cl3N5O3
Molecular Weight	530.88
AlogP	3.23
Hydrogen Bond Acceptor	6.0
Number of Rotational Bond	8.0
Polar Surface Area	72.6
Molecular species	NEUTRAL
Aromatic Rings	2.0
Heavy Atoms	32.0

Property Name

Value

Molecular Formula

C23H30Cl3N5O3

Molecular Weight

530.88

AlogP

3.23

Hydrogen Bond Acceptor

6.0

Number of Rotational Bond

8.0

Polar Surface Area

72.6

Molecular species

NEUTRAL

Aromatic Rings

2.0

Heavy Atoms

32.0

Resources	Reference
ChEMBL	CHEMBL3140370
FDA SRS	6E6VJP68KR
PubChem	60938
SureChEMBL	SCHEMBL126475

Resources

Reference

ChEMBL

FDA SRS

PubChem

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...

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Last update: Monday, 3 November 2025

AZIMILIDE DIHYDROCHLORIDE

Structure

Physicochemical Descriptors

Cross References