EcoDrugPlus


Synonyms	Buformin Buformin hydrochloride DBV W 37
Status
Molecule Category	Free-form
ATC	A10BA03
UNII	W2115E9C7B
EPA CompTox	DTXSID6046420


InChI Key	XSEUMFJMFFMCIU-UHFFFAOYSA-N
Smiles	CCCCNC(=N)NC(=N)N
InChI	InChI=1S/C6H15N5/c1-2-3-4-10-6(9)11-5(7)8/h2-4H2,1H3,(H6,7,8,9,10,11)

Property Name	Value
Molecular Formula	C6H15N5
Molecular Weight	157.22
AlogP	-0.63
Hydrogen Bond Acceptor	1.0
Hydrogen Bond Donor	3.0
Number of Rotational Bond	3.0
Polar Surface Area	102.78
Molecular species	BASE
Aromatic Rings	0.0
Heavy Atoms	11.0

Resources	Reference
ChEBI	3209
ChEMBL	CHEMBL39736
DrugBank	DB04830
DrugCentral	423
FDA SRS	W2115E9C7B
KEGG	C07674
PDB	BFR
PubChem	2468
SureChEMBL	SCHEMBL27451
ZINC	ZINC000004097425

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

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