EcoDrugPlus


Synonyms	BMS-663068 Bms-663068 free acid Fostemsavir
Status
Molecule Category	Free-form
ATC	J05AX29
UNII	97IQ273H4L
EPA CompTox	DTXSID40235596


InChI Key	SWMDAPWAQQTBOG-UHFFFAOYSA-N
Smiles	COc1cnc(-n2cnc(C)n2)c2c1c(C(=O)C(=O)N1CCN(C(=O)c3ccccc3)CC1)cn2COP(=O)(O)O
InChI	InChI=1S/C25H26N7O8P/c1-16-27-14-32(28-16)23-21-20(19(39-2)12-26-23)18(13-31(21)15-40-41(36,37)38)22(33)25(35)30-10-8-29(9-11-30)24(34)17-6-4-3-5-7-17/h3-7,12-14H,8-11,15H2,1-2H3,(H2,36,37,38)

Property Name	Value
Molecular Formula	C25H26N7O8P
Molecular Weight	583.5
AlogP	1.17
Hydrogen Bond Acceptor	11.0
Hydrogen Bond Donor	2.0
Number of Rotational Bond	8.0
Polar Surface Area	182.21
Molecular species	ACID
Aromatic Rings	4.0
Heavy Atoms	41.0

Mechanism of Action	Action	Reference
Envelope polyprotein GP160 inhibitor	INHIBITOR	FDA

Resources	Reference
ChEMBL	CHEMBL3301594
DrugBank	DB11796
FDA SRS	97IQ273H4L
Guide to Pharmacology	11100
PubChem	11319217
SureChEMBL	SCHEMBL754395
ZINC	ZINC000014210883

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

FOSTEMSAVIR

Structure

Physicochemical Descriptors

Pharmacology

Related Entries

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