None is not found in the database.

LEVOKETOCONAZOLE


Synonyms	(-)-(2s,4r)-ketoconazole 2s,4r ketoconazole 2s,4r-ketoconazole COR-003 COR003 DIO-902 Extina Ketoconazole, (2s,4r)- Ketosidin Ketozole Levoketoconazole Nizoral Nizoral A-D Normocort Panfungol
Status
Molecule Category	Free-form
UNII	R9400W927I
EPA CompTox	DTXSID60161949


InChI Key	XMAYWYJOQHXEEK-ZEQKJWHPSA-N
Smiles	CC(=O)N1CCN(c2ccc(OC[C@@H]3CO[C@@](Cn4ccnc4)(c4ccc(Cl)cc4Cl)O3)cc2)CC1
InChI	InChI=1S/C26H28Cl2N4O4/c1-19(33)31-10-12-32(13-11-31)21-3-5-22(6-4-21)34-15-23-16-35-26(36-23,17-30-9-8-29-18-30)24-7-2-20(27)14-25(24)28/h2-9,14,18,23H,10-13,15-17H2,1H3/t23-,26-/m1/s1

Property Name	Value
Molecular Formula	C26H28Cl2N4O4
Molecular Weight	531.44
AlogP	4.21
Hydrogen Bond Acceptor	7.0
Number of Rotational Bond	7.0
Polar Surface Area	69.06
Molecular species	NEUTRAL
Aromatic Rings	3.0
Heavy Atoms	36.0

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Cytochrome P450 Cytochrome P450 family 3 Cytochrome P450 family 3A Cytochrome P450 3A4	-	26.9	-	-	-

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Homo sapiens	-	26.9	-	-	-

Header

Compound Name

Maximum Phase

Compound Structure

Smile

Inchi

InchiKey

Compound Properties

Molecular Formula

Molecular Weight

ALogP

PSA

Resources	Reference
ChEBI	47518
ChEMBL	CHEMBL295698
DrugBank	DB05667
FDA SRS	R9400W927I
Human Metabolome Database	HMDB0012242
PDB	KLN
PharmGKB	PA450146
PubChem	47576
SureChEMBL	SCHEMBL41473
ZINC	ZINC000000643153

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

LEVOKETOCONAZOLE

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Physicochemical Descriptors

Pharmacology

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