GREPAFLOXACIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H22FN3O3
Molecular Weight	359.3947
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of GREPAFLOXACIN

Structure Search

SMILES

CC1CN(CCN1)C2=C(F)C(C)=C3C(=O)C(=CN(C4CC4)C3=C2)C(O)=O

InChI

InChIKey=AIJTTZAVMXIJGM-UHFFFAOYSA-N

InChI=1S/C19H22FN3O3/c1-10-8-22(6-5-21-10)15-7-14-16(11(2)17(15)20)18(24)13(19(25)26)9-23(14)12-3-4-12/h7,9-10,12,21H,3-6,8H2,1-2H3,(H,25,26)

HIDE SMILES / InChI

Molecular Formula	C19H22FN3O3
Molecular Weight	359.3947
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:23:34 UTC 2023` Edited by `admin` on `Fri Dec 15 17:23:34 UTC 2023`
Record UNII	L1M1U2HC31
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

GREPAFLOXACIN

Official Name

English

3-QUINOLINECARBOXYLIC ACID, 1-CYCLOPROPYL-6-FLUORO-1,4-DIHYDRO-5-METHYL-7-(3-METHYL-1-PIPERAZINYL)-4-OXO-, (±)-

Common Name

English

Grepafloxacin [WHO-DD]

Common Name

English

3-QUINOLINECARBOXYLIC ACID, 1-CYCLOPROPYL-6-FLUORO-1,4-DIHYDRO-5-METHYL-7-(3-METHYL-1-PIPERAZINYL)-4-OXO-

Systematic Name

English

(±)-1-CYCLOPROPYL-6-FLUORO-1,4-DIHYDRO-5-METHYL-7-(3-METHYL-1-PIPERAZINYL)-4-OXO-3-QUINOLINECARBOXYLIC ACID

Systematic Name

English

GREPAFLOXACIN [MI]

Common Name

English

grepafloxacin [INN]

Common Name

English

GREPAFLOXACIN [VANDF]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C795

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

WHO-VATC

QJ01MA11

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

WHO-ATC

J01MA11

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

Code System Code Type Description

CAS

119914-60-2

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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DRUG CENTRAL

1330

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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RXCUI

83719

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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RxNorm

PUBCHEM

72474

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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SMS_ID

100000084239

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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FDA UNII

L1M1U2HC31

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

PRIMARY

EVMPD

SUB07965MIG

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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ChEMBL

CHEMBL583

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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EPA CompTox

DTXSID2048321

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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DRUG BANK

DB00365

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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WIKIPEDIA

GREPAFLOXACIN

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

PRIMARY

MESH

C075375

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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MERCK INDEX

m5850

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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Merck Index

NCI_THESAURUS

C65817

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

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INN

7024

Created by admin on Fri Dec 15 17:23:34 UTC 2023 , Edited by admin on Fri Dec 15 17:23:34 UTC 2023

PRIMARY

Related Record Type Details


					NO045R4X1D

GREPAFLOXACIN DIHYDRATE

SOLVATE->ANHYDROUS


					B60Q83J4KP

GREPAFLOXACIN, (R)-

ENANTIOMER -> RACEMATE


					NO045R4X1D

GREPAFLOXACIN DIHYDRATE

SALT/SOLVATE -> PARENT


					A4ER1Z8N9N

GREPAFLOXACIN HYDROCHLORIDE

SALT/SOLVATE -> PARENT


					3U6TN9Y2LD

MYCOPLASMA FERMENTANS

TARGET ORGANISM->INHIBITOR

Comments:

18 STRAINS; SOME LESS THE 8 ng/mL for many strains; MIC range listed

Qualification:

MIC90

Amount:


					482M00274D

OCT-2

TRANSPORTER -> INHIBITOR


					6D53G0FD0Z

PLASMA PROTEIN FRACTION (HUMAN)

BINDER->LIGAND

Interaction Type:

BINDING

Amount:


					1QUW88X868

GREPAFLOXACIN, (S)-

ENANTIOMER -> RACEMATE


					5487J3Q1MN

GREPAFLOXACIN HYDROCHLORIDE HYDRATE

SALT/SOLVATE -> PARENT

Related Record Type Details


					L1M1U2HC31

ACTIVE MOIETY

Name	Property Type	Amount	Referenced Substance	Defining	Parameters	References
Volume of Distribution	PHARMACOKINETIC

Biological Half-life	PHARMACOKINETIC