EcoDrugPlus


Synonyms	IDS-NS-001 R 30,730 R-30730 Sufentanil Sufentanyl
Status
Molecule Category	Free-form
ATC	N01AH03
UNII	AFE2YW0IIZ
EPA CompTox	DTXSID6023604


InChI Key	GGCSSNBKKAUURC-UHFFFAOYSA-N
Smiles	CCC(=O)N(c1ccccc1)C1(COC)CCN(CCc2cccs2)CC1
InChI	InChI=1S/C22H30N2O2S/c1-3-21(25)24(19-8-5-4-6-9-19)22(18-26-2)12-15-23(16-13-22)14-11-20-10-7-17-27-20/h4-10,17H,3,11-16,18H2,1-2H3

Property Name	Value
Molecular Formula	C22H30N2O2S
Molecular Weight	386.56
AlogP	4.21
Hydrogen Bond Acceptor	4.0
Number of Rotational Bond	8.0
Polar Surface Area	32.78
Molecular species	BASE
Aromatic Rings	2.0
Heavy Atoms	27.0

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Short peptide receptor (family A GPCR) Opioid receptor	1.3-1.5	0.4-2.3	-	0.02-0.22	-

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Cavia porcellus	7.43	-	-	-	-
Homo sapiens	1.3-1.5	-	-	-	-
Rattus norvegicus	-	0.4-2.3	-	-	-

Resources	Reference
ChEBI	9316
ChEMBL	CHEMBL658
DrugBank	DB00708
DrugCentral	2491
FDA SRS	AFE2YW0IIZ
Human Metabolome Database	HMDB0014846
Guide to Pharmacology	3534
KEGG	C08022
PharmGKB	PA451527
PubChem	41693
SureChEMBL	SCHEMBL26728
ZINC	ZINC000000538386

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

SUFENTANIL

Structure

Physicochemical Descriptors

Pharmacology

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