EcoDrugPlus


Synonyms	NM-441 NM441 NSC-759833 Prulifloxacin Pruvel
Status
Molecule Category	Free-form
ATC	J01MA17
UNII	J42298IESW
EPA CompTox	DTXSID0046480

Synonyms

NM-441

NM441

NSC-759833

Prulifloxacin

Pruvel

Status

Molecule Category

Free-form

ATC

J01MA17

UNII

J42298IESW

EPA CompTox

DTXSID0046480


InChI Key	PWNMXPDKBYZCOO-UHFFFAOYSA-N
Smiles	Cc1oc(=O)oc1CN1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)c2n3C(C)S2)CC1
InChI	InChI=1S/C21H20FN3O6S/c1-10-16(31-21(29)30-10)9-23-3-5-24(6-4-23)15-8-14-12(7-13(15)22)18(26)17(20(27)28)19-25(14)11(2)32-19/h7-8,11H,3-6,9H2,1-2H3,(H,27,28)

InChI Key

PWNMXPDKBYZCOO-UHFFFAOYSA-N

Smiles

Cc1oc(=O)oc1CN1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)c2n3C(C)S2)CC1

InChI

InChI=1S/C21H20FN3O6S/c1-10-16(31-21(29)30-10)9-23-3-5-24(6-4-23)15-8-14-12(7-13(15)22)18(26)17(20(27)28)19-25(14)11(2)32-19/h7-8,11H,3-6,9H2,1-2H3,(H,27,28)

Property Name	Value
Molecular Formula	C21H20FN3O6S
Molecular Weight	461.47
AlogP	2.64
Hydrogen Bond Acceptor	9.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	4.0
Polar Surface Area	109.13
Molecular species	ACID
Aromatic Rings	3.0
Heavy Atoms	32.0

Property Name

Value

Molecular Formula

C21H20FN3O6S

Molecular Weight

461.47

AlogP

2.64

Hydrogen Bond Acceptor

9.0

Hydrogen Bond Donor

1.0

Number of Rotational Bond

4.0

Polar Surface Area

109.13

Molecular species

ACID

Aromatic Rings

3.0

Heavy Atoms

32.0

Mechanism of Action	Action	Reference
Bacterial DNA gyrase inhibitor	INHIBITOR	Other PubMed

Mechanism of Action

Action

Reference

Bacterial DNA gyrase inhibitor

INHIBITOR

Other PubMed

Resources	Reference
ChEBI	32071
ChEMBL	CHEMBL422648
DrugBank	DB11892
DrugCentral	2325
FDA SRS	J42298IESW
PubChem	65947
SureChEMBL	SCHEMBL1650794

Resources

Reference

ChEBI

ChEMBL

DrugBank

DrugCentral

FDA SRS

PubChem

SureChEMBL

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

PRULIFLOXACIN

Structure

Physicochemical Descriptors

Pharmacology

Cross References