MINOCYCLINE


Synonyms	Minocycline
Status
Molecule Category	Free-form
ATC	A01AB23 D10AF07 J01AA08
UNII	FYY3R43WGO
EPA CompTox	DTXSID1045033


InChI Key	DYKFCLLONBREIL-KVUCHLLUSA-N
Smiles	CN(C)c1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(O)=C(C(N)=O)C(=O)[C@@]3(O)C(O)=C1C2=O
InChI	InChI=1S/C23H27N3O7/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28/h5-6,9,11,17,27,29-30,33H,7-8H2,1-4H3,(H2,24,32)/t9-,11-,17-,23-/m0/s1

Property Name	Value
Molecular Formula	C23H27N3O7
Molecular Weight	457.48
AlogP	0.19
Hydrogen Bond Acceptor	9.0
Hydrogen Bond Donor	5.0
Number of Rotational Bond	3.0
Polar Surface Area	164.63
Molecular species	ACID
Aromatic Rings	1.0
Heavy Atoms	33.0

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Hydrolase	-	-	-	-	-8.62--0.24
Unclassified protein	-	-	-	-	40

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Electrophorus electricus	-	-	-	-
Equus caballus	-	-	-	-
Escherichia coli K-12	-	-	-	-	45
Klebsiella pneumoniae subsp. pneumoniae	700	-	-	-	-
Mus musculus	-	-	-	-	15.6-59.7
Staphylococcus aureus subsp. aureus	350	-	-	-	-

Header

Compound Name

Maximum Phase

Compound Structure

Smile

Inchi

InchiKey

Compound Properties

Molecular Formula

Molecular Weight

ALogP

PSA

Countries
Croatia
Czech Republic
Germany
Hungary
Romania
Serbia
Slovakia
Slovenia

Resources	Reference
ChEBI	50694
ChEMBL	CHEMBL1434
DrugBank	DB01017
DrugCentral	1813
FDA SRS	FYY3R43WGO
Human Metabolome Database	HMDB0015152
Guide to Pharmacology	10831
KEGG	C07225
PDB	MIY
SureChEMBL	SCHEMBL4042
ZINC	ZINC000014879992

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

MINOCYCLINE

Structure

Physicochemical Descriptors

Pharmacology

Related Entries

Environmental Exposure

Cross References