EcoDrugPlus


Synonyms	Fluorofuranylnorprogesterone
Status
Molecule Category	Free-form
UNII	K56K9G4PPM

Synonyms

Fluorofuranylnorprogesterone

Status

Molecule Category

Free-form

UNII

K56K9G4PPM


InChI Key	VJKRBRUNEOHPBS-BUPULCDWSA-N
Smiles	C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1C[C@H]1O[C@@H](c3ccco3)O[C@]12C(=O)CF
InChI	InChI=1S/C25H29FO5/c1-24-9-8-17-16-7-5-15(27)11-14(16)4-6-18(17)19(24)12-22-25(24,21(28)13-26)31-23(30-22)20-3-2-10-29-20/h2-3,10-11,16-19,22-23H,4-9,12-13H2,1H3/t16-,17+,18+,19-,22+,23+,24-,25+/m0/s1

InChI Key

VJKRBRUNEOHPBS-BUPULCDWSA-N

Smiles

C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@H]43)[C@@H]1C[C@H]1O[C@@H](c3ccco3)O[C@]12C(=O)CF

InChI

InChI=1S/C25H29FO5/c1-24-9-8-17-16-7-5-15(27)11-14(16)4-6-18(17)19(24)12-22-25(24,21(28)13-26)31-23(30-22)20-3-2-10-29-20/h2-3,10-11,16-19,22-23H,4-9,12-13H2,1H3/t16-,17+,18+,19-,22+,23+,24-,25+/m0/s1

Property Name	Value
Molecular Formula	C25H29FO5
Molecular Weight	428.5
AlogP	4.72
Hydrogen Bond Acceptor	5.0
Number of Rotational Bond	3.0
Polar Surface Area	65.74
Molecular species	NEUTRAL
Aromatic Rings	1.0
Heavy Atoms	31.0

Property Name

Value

Molecular Formula

C25H29FO5

Molecular Weight

428.5

AlogP

4.72

Hydrogen Bond Acceptor

5.0

Number of Rotational Bond

3.0

Polar Surface Area

65.74

Molecular species

NEUTRAL

Aromatic Rings

1.0

Heavy Atoms

31.0

Resources	Reference
ChEMBL	CHEMBL378031
FDA SRS	K56K9G4PPM
PubChem	11453125
ZINC	ZINC000003932055

Resources

Reference

ChEMBL

FDA SRS

PubChem

ZINC

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

FLUOROFURANYLNORPROGESTERONE

Structure

Physicochemical Descriptors

Cross References