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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL354077
CHEMBL354077
Compound Name AMIFAMPRIDINE
ChEMBL Synonyms DAP | DAPP | 4-DAP | Amifampridine phosphate | Amifampridine | Pyridine-3,4-Diamine | 3,4-Diammoniopyridinium | 3,4-DAPP
Max Phase 0
Trade Names
Molecular Formula C5H7N3

Additional synonyms for CHEMBL354077 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Nc1ccncc1N
Standard InChI InChI=1S/C5H7N3/c6-4-1-2-8-3-5(4)7/h1-3H,7H2,(H2,6,8)
Standard InChI Key OYTKINVCDFNREN-UHFFFAOYSA-N

Molecule Features

CHEMBL354077 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Achiral Molecule Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Structural Alerts

There are no structural alerts for CHEMBL354077

Alternate Forms of Compound in ChEMBL


CHEMBL354077

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
109.1 109.064 -0.81 0 64.92 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
3 2 0 3 4 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 9.17 -.34 -1.67 1 8 0.46

Compound Cross References

ATC N - NERVOUS SYSTEM
N07 - OTHER NERVOUS SYSTEM DRUGS
N07X - OTHER NERVOUS SYSTEM DRUGS
N07XX - Other nervous system drugs
N07XX05 - amifampridine

ChemSpider ChemSpider:OYTKINVCDFNREN-UHFFFAOYSA-N
PubChem SID: 144206108 SID: 170466846 SID: 50112814 SID: 51088028 SID: 56323425
Wikipedia 3,4-Diaminopyridine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL354077



ACToR 54-96-6
BindinDB 50416493
eMolecules 498389
FDA SRS RU4S6E2G0J
IBM Patent System A212AC8E2965DBCD624E9DA2EE3F115D
IBM Patents EP1854449A1 EP0452101A3 US20100139012 US6884890 US6733540 US20100324059 US4758574 US20040237216 US7560100 US20060021161 EP1066286B1 EP0998258B1 US7204858 EP1428507A1 US20100272796 EP1641423B1 WO2002100364A1 US7749503 US20020170121 US6306867 US20100292188 US20030028977 US5512067 US20100204259 EP1234569B1 EP1607393A1 EP1660032A1 EP1859782A1 US6733539 EP0588859A1 EP2198832A1 EP1066263A1 US7485156 EP1716839A1 WO2006106000A1 WO2004082684A1 EP1205176A1 EP1433470A1 WO2002026200A1 WO2006123061A3 US4871877 US20060085923 EP0982343A3 EP1299073A2 US20040244123 WO2006119820A1 US6565962 US20030163876 EP1433470B1 EP2011787A1 US7642360 US5612279 US20010055736 EP1443889A1 WO2002076417A1 WO1989008653A1 US20090235467 EP1274392A1 WO2002100366A2 US5620978 EP1554094B9 US20040200012 US20050090472 US5646153 US20100154139 WO2009047022A1 EP1559407A1 US20090074701 EP1655017A1 US7172631 US20080151373 EP1671952A1 WO2009027237A2 EP1619220A1 EP1341504B1 EP1859781A2 US5558683 US4772600 EP0776933A1 US20020002749 US6572843 EP1996145A2 WO2010023559A2 WO2007023186A1 US6586459 EP0694594A3 US20080090806 US5073561 US20060019965 EP1422218A1 US20010049850 US20040031950 US5151424 US4996201 WO1999017722A1 US7311966 US5306718 EP0303391B1 US20080292568 US20020013310
Mcule MCULE-5478459845
MolPort MolPort-000-139-949
Nikkaji J51.295H
NMRShiftDB 10017792
PubChem 5918
PubChem: Thomson Pharma 15170514
SureChEMBL SCHEMBL21273

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/OYTKINVCDFNREN-UHFFFAOYSA-N spacer
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