e-Drug3D

1087

ARTEMETHER

INN
ARTEMETHER

(has an active metabolite)

cas 71963-77-4

CLASS

ANTIPARASITIC
ANTIMALARIALS
ARTEMISIN DERIVATIVE
ENDOPEROXIDE GROUP

ROUTE (list)

ORAL

ATC code

P01BE02
P01BF01

PK parameters

Tmax 2 HOUR
PPB 95.4 PERCENT
t1/2 2 HOUR

Solubility

PRACTICALLY INSOLUBLE IN WATER

Target

-

PDB
6FGD (CRYSTAL STRUCTURE OF GEPHYRIN E DOMAIN IN COMPLEX WITH ARTEMETHER)

Ligand code = D8Z (link to the list of PDB complexes)

Download experimental 3D coordinates of D8Z with added hydrogens

Unknown

Download SDF file

3,12-Epoxy-12H-pyrano[4,3-j]-1,2-benzodioxepin, decahydro-10-methoxy-3,6,9-trimethyl-, (3R,5aS,6R,8aS,9R,10S,12R,12aR)-

Formula:
C16H26O5

Calculated chemical properties:

MW 298.37
NB_atoms 21
XLogP 2.84
PSA 46.838
NB_HD 0
NB_HA 5
fsp3 1.00
Lipinski(0=no;1=yes) 1

FDA
NDA 022268 (label) INN (ARTEMETHER ; LUMEFANTRINE) COARTEM (NOVARTIS) APPROVAL= AP YEAR= 2009

Other links:

PubChem
ChemicalProbes

U.S. repository of Clinical Trials

VigiAccess
SIDER side effects

ChemSynthesis
Patent@SureChEMBL

e-Drug3D

1092

DIHYDROARTEMISININ

INN
DIHYDROARTEMISININ

(is an active metabolite)

cas 71939-50-9

CLASS

ANTIPARASITIC
ANTIMALARIALS
ARTEMISIN DERIVATIVE
ENDOPEROXIDE GROUP

ROUTE (list)

-

ATC code

P01BE01
P01BF08
P01BF07

PK parameters

Tmax 2 HOUR
PPB 61 PERCENT
t1/2 2 HOUR

Target

-

Unknown

Download SDF file

3,12-Epoxy-12H-pyrano[4,3-j]-1,2-benzodioxepin-10-ol, decahydro-3,6,9-trimethyl-, (3R,5aS,6R,8aS,9R,10S,12R,12aR)-

Formula:
C15H24O5

Calculated chemical properties:

MW 284.34
NB_atoms 20
XLogP 2.19
PSA 58.013
NB_HD 1
NB_HA 5
fsp3 1.00
Lipinski(0=no;1=yes) 1

FDA
-

Other links:

PubChem
ChemicalProbes

U.S. repository of Clinical Trials

VigiAccess
SIDER side effects

ChemSynthesis
Patent@SureChEMBL