e-Drug3D

804

RALOXIFENE


INN
RALOXIFENE

cas 84449-90-1
CLASS

GENITO
TREATMENT AND PREVENTION OF OSTEOPOROSIS IN POSTMENOPAUSAL WOMEN
ANTINEOPLASTIC
ANTIHYPOCALCEMIC AGENTS
BONE DENSITY CONSERVATION AGENTS
ESTROGEN RECEPTOR AGONIST/ANTAGONIST

ROUTE (list)

ORAL

ATC code

G03XC01

PK parameters

F 2 PERCENT
VD 152620 LITER (65 KILOGRAM)
Cl 2866 LITER / HOUR (65 KILOGRAM)
PPB 95 PERCENT
t1/2 27.7 HOUR

Solubility

SLIGHTLY SOLUBLE IN WATER


Target

TARGET ESTROGEN RECEPTOR BETA

PDB
1ERR (HUMAN ESTROGEN RECEPTOR LIGAND-BINDING DOMAIN IN COMPLEX WITH RALOXIFENE)

Ligand code = RAL (link to the list of PDB complexes)

Download experimental 3D coordinates of RAL with added hydrogens

DrugCentral

Estrogen receptor UNIPROT P03372 ESR1

Estrogen receptor beta UNIPROT Q92731 ESR2

Download SDF file [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone

Formula:
C28H27NO4S

Calculated chemical properties:

MW 473.58
NB_atoms 34
XLogP 6.08
PSA 75.243
NB_HD 2
NB_HA 5
fsp3 0.25
Lipinski(0=no;1=yes) 0

FDA
NDA 020815 (pdf not found) INN (RALOXIFENE HYDROCHLORIDE) EVISTA (LILLY) APPROVAL= AP YEAR= 1997
NDA 022042 (pdf not found) INN (RALOXIFENE HYDROCHLORIDE) EVISTA (LILLY) APPROVAL= AP YEAR= 2007 NEWAPPLICATION
NDA 078193 (pdf not found) INN (RALOXIFENE HYDROCHLORIDE) RALOXIFENE HYDROCHLORIDE (TEVA PHARMS USA) APPROVAL= AP YEAR= 2014
NDA 090842 (pdf not found) INN (RALOXIFENE HYDROCHLORIDE) RALOXIFENE HYDROCHLORIDE (INVAGEN PHARMS) APPROVAL= AP YEAR= 2014
NDA 200825 (pdf not found) INN (RALOXIFENE HYDROCHLORIDE) RALOXIFENE HYDROCHLORIDE (WATSON LABS INC) APPROVAL= AP YEAR= 2015
NDA 204310 (pdf not found) INN (RALOXIFENE HYDROCHLORIDE) RALOXIFENE HYDROCHLORIDE (AUROBINDO PHARMA) APPROVAL= AP YEAR= 2015
NDA 204491 (pdf not found) INN (RALOXIFENE HYDROCHLORIDE) RALOXIFENE HYDROCHLORIDE (GLENMARK PHARMS LTD) APPROVAL= AP YEAR= 2016
NDA 208206 (pdf not found) INN (RALOXIFENE HYDROCHLORIDE) RALOXIFENE HYDROCHLORIDE (AMNEAL PHARMS) APPROVAL= AP YEAR= 2016
NDA 206384 (pdf not found) INN (RALOXIFENE HYDROCHLORIDE) RALOXIFENE HYDROCHLORIDE (SCIEGEN PHARMS INC) APPROVAL= AP YEAR= 2016
NDA 211324 (pdf not found) INN (RALOXIFENE HYDROCHLORIDE) RALOXIFENE HYDROCHLORIDE (CADILA PHARMS LTD) APPROVAL= AP YEAR= 2020

Other links:

PubChem
ChemicalProbes

U.S. repository of Clinical Trials

VigiAccess
SIDER side effects

ChemSynthesis
Patent@SureChEMBL