EcoDrugPlus


Synonyms	BMS-207147 ER-30346 Ravuconazole
Status
Molecule Category	Free-form
UNII	95YH599JWV
EPA CompTox	DTXSID40171329


InChI Key	OPAHEYNNJWPQPX-RCDICMHDSA-N
Smiles	C[C@@H](c1nc(-c2ccc(C#N)cc2)cs1)[C@](O)(Cn1cncn1)c1ccc(F)cc1F
InChI	InChI=1S/C22H17F2N5OS/c1-14(21-28-20(10-31-21)16-4-2-15(9-25)3-5-16)22(30,11-29-13-26-12-27-29)18-7-6-17(23)8-19(18)24/h2-8,10,12-14,30H,11H2,1H3/t14-,22+/m0/s1

Property Name	Value
Molecular Formula	C22H17F2N5OS
Molecular Weight	437.48
AlogP	4.24
Hydrogen Bond Acceptor	7.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	6.0
Polar Surface Area	87.62
Molecular species	NEUTRAL
Aromatic Rings	4.0
Heavy Atoms	31.0

Mechanism of Action	Action	Reference
Cytochrome P450 51 inhibitor	INHIBITOR	PubMed

Resources	Reference
ChEBI	143825
ChEMBL	CHEMBL294029
DrugBank	DB06440
FDA SRS	95YH599JWV
PubChem	467825
SureChEMBL	SCHEMBL939026
ZINC	ZINC000000600547

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...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

RAVUCONAZOLE

Structure

Physicochemical Descriptors

Pharmacology

Related Entries

Cross References