Details of the Drug

General Information of Drug (ID: DM59G40)

Drug Name

Rimeporide

Synonyms

EMD-87580; EMR-204; EMR-62204; NHE inhibitors (atrial fibrillation), Merck KGaA; Sodium/hydrogen exchange inhibitors (atrial fibrillation), Merck KGaA

Indication

Disease Entry	ICD 11	Status	REF
Myocardial infarction	BA41-BA43	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski): 0

Molecular Weight (mw)

333.4

Logarithm of the Partition Coefficient (xlogp)

-0.3

Rotatable Bond Count (rotbonds)

3

Hydrogen Bond Donor Count (hbonddonor)

2

Hydrogen Bond Acceptor Count (hbondacc)

5

Chemical Identifiers

Formula: C11H15N3O5S2
IUPAC Name: N-(diaminomethylidene)-2-methyl-4,5-bis(methylsulfonyl)benzamide
Canonical SMILES: CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)S(=O)(=O)C
InChI: InChI=1S/C11H15N3O5S2/c1-6-4-8(20(2,16)17)9(21(3,18)19)5-7(6)10(15)14-11(12)13/h4-5H,1-3H3,(H4,12,13,14,15)
InChIKey: GROMEQPXDKRRIE-UHFFFAOYSA-N

Cross-matching ID

PubChem CID: 9799487
CAS Number: 187870-78-6
DrugBank ID: DB12861
TTD ID: D0F1PH

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Sodium/hydrogen exchanger (SLC)	TT70SZ3	NOUNIPROTAC	Inhibitor	[2]

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Molecular Interaction Atlas (MIA)

MIA Detail

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800042366)
2	Sodium-hydrogen exchanger, cardiac overload, and myocardial hypertrophy. Circulation. 2007 Mar 6;115(9):1090-100.