EcoDrugPlus


Synonyms	Arzoxifene hcl Arzoxifene hydrochloride LY-353381.HCL LY353381.HCL SERM 3 SERM-3
Status
Molecule Category	Salt-form
UNII	FU88PI0433
Parent Compound:	ARZOXIFENE

Synonyms

Arzoxifene hcl

Arzoxifene hydrochloride

LY-353381.HCL

LY353381.HCL

SERM 3

SERM-3

Status

Molecule Category

Salt-form

UNII

FU88PI0433

Parent Compound:

ARZOXIFENE


InChI Key	NHSNLUIMAQQXGR-UHFFFAOYSA-N
Smiles	COc1ccc(-c2sc3cc(O)ccc3c2Oc2ccc(OCCN3CCCCC3)cc2)cc1.Cl
InChI	InChI=1S/C28H29NO4S.ClH/c1-31-22-8-5-20(6-9-22)28-27(25-14-7-21(30)19-26(25)34-28)33-24-12-10-23(11-13-24)32-18-17-29-15-3-2-4-16-29;/h5-14,19,30H,2-4,15-18H2,1H3;1H

InChI Key

NHSNLUIMAQQXGR-UHFFFAOYSA-N

Smiles

COc1ccc(-c2sc3cc(O)ccc3c2Oc2ccc(OCCN3CCCCC3)cc2)cc1.Cl

InChI

InChI=1S/C28H29NO4S.ClH/c1-31-22-8-5-20(6-9-22)28-27(25-14-7-21(30)19-26(25)34-28)33-24-12-10-23(11-13-24)32-18-17-29-15-3-2-4-16-29;/h5-14,19,30H,2-4,15-18H2,1H3;1H

Property Name	Value
Molecular Formula	C28H30ClNO4S
Molecular Weight	512.07
AlogP	6.94
Hydrogen Bond Acceptor	6.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	8.0
Polar Surface Area	51.16
Molecular species	BASE
Aromatic Rings	4.0
Heavy Atoms	34.0

Property Name

Value

Molecular Formula

C28H30ClNO4S

Molecular Weight

512.07

AlogP

6.94

Hydrogen Bond Acceptor

6.0

Hydrogen Bond Donor

1.0

Number of Rotational Bond

8.0

Polar Surface Area

51.16

Molecular species

BASE

Aromatic Rings

4.0

Heavy Atoms

34.0

Resources	Reference
ChEMBL	CHEMBL2105949
FDA SRS	FU88PI0433
PubChem	179338
SureChEMBL	SCHEMBL699600

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

ARZOXIFENE HYDROCHLORIDE

Structure

Physicochemical Descriptors

Cross References