EcoDrugPlus


Synonyms	2-phenyl-.gamma.-benzopyrone 2-phenyl-1,4-benzopyrone Asmacoril Chromocor Cromaril Cromarile Flavone NSC-19028
Status
Molecule Category	Free-form
UNII	S2V45N7G3B
EPA CompTox	DTXSID2022048


InChI Key	VHBFFQKBGNRLFZ-UHFFFAOYSA-N
Smiles	O=c1cc(-c2ccccc2)oc2ccccc12
InChI	InChI=1S/C15H10O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-10H

Property Name	Value
Molecular Formula	C15H10O2
Molecular Weight	222.24
AlogP	3.46
Hydrogen Bond Acceptor	2.0
Number of Rotational Bond	1.0
Polar Surface Area	30.21
Molecular species	NEUTRAL
Aromatic Rings	3.0
Heavy Atoms	17.0

Targets	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Enzyme Cytochrome P450 Cytochrome P450 family 1 Cytochrome P450 family 1B Cytochrome P450 1B1	-	600	-	-	-
Enzyme Cytochrome P450 Cytochrome P450 family 19 Cytochrome P450 family 19A Cytochrome P450 19A1	-	8	-	-	-
Enzyme Isomerase	-	-	-	-	52-83
Enzyme Kinase Protein Kinase Atypical protein kinase group Atypical protein kinase PDHK subfamily	-	-	-	-
Enzyme Oxidoreductase	-	-	-	-	15.4-92.2
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4A	-	-	-	-	50
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4B	-	-	-	-	50
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4C	-	-	-	-	50
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4D	-	-	-	-	50
Enzyme Protease Metallo protease Metallo protease MAE clan Metallo protease M1 family	-	-	-	-	5
Enzyme Protease Serine protease Serine protease SC clan Serine protease S9B subfamily	-	170	-	-	-
Enzyme Transferase	-	140-330	-	-	-
Ion channel Ligand-gated ion channel GABA-A receptor	-	-	-	17	-
Unclassified protein	-	-	-	-	0-87

	EC50(nM)	IC50(nM)	Kd(nM)	Ki(nM)	Inhibition(%)
Bos taurus	-	240	-	-	15.4
Homo sapiens	-	8-600	-	-	-1.93-87
Mus musculus	-	500	-	-	16.33
Plasmodium falciparum	-	2	-	-	-
Rattus norvegicus	-	-	-	33-190	-
Trypanosoma cruzi	-	-	-	-	52-83

Resources	Reference
ChEBI	42491
ChEMBL	CHEMBL275638
DrugBank	DB07776
FDA SRS	S2V45N7G3B
Human Metabolome Database	HMDB0003075
Guide to Pharmacology	409
KEGG	C15608
PDB	FLN
PubChem	10680
SureChEMBL	SCHEMBL18879
ZINC	ZINC000000057674

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

FLAVONE

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Physicochemical Descriptors

Pharmacology

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