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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL39677
CHEMBL39677
Compound Name ACRIDINE
ChEMBL Synonyms Acridine
Max Phase 0
Trade Names
Molecular Formula C13H9N

Additional synonyms for CHEMBL39677 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES c1ccc2nc3ccccc3cc2c1
Standard InChI InChI=1S/C13H9N/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1 ...
Download InChI
Standard InChI Key DZBUGLKDJFMEHC-UHFFFAOYSA-N

Structural Alerts

There are 4 structural alerts for CHEMBL39677. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL39677

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
179.2 179.0735 3.35 0 12.89 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
1 0 0 1 0 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 5.56 3.45 3.44 3 14 0.48

Compound Cross References

ChemSpider ChemSpider:DZBUGLKDJFMEHC-UHFFFAOYSA-N
PubChem SID: 124892352 SID: 26755289
Wikipedia Acridine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL39677



ACToR 260-94-6
ChEBI 36420
eMolecules 474863
FDA SRS 42NI1P5Q1X
IBM Patent System DD5E0233BC040E6CF85D6E6316E9C56D
IBM Patents US7553644 US7419814 US20050119470 WO2006021343A2 US5561017 WO2001036661A2 US20030229138 WO2005054861A1 US20100216166 US7049305 WO2001094336A1 WO1997043377A1 WO2003104447A1 US20010034034 EP1099983A1 US6685941 US20030144225 US6780987 EP1827519A2 US20060035329 US20090198453 EP0210709A2 US7518721 US7217299 US20100104832 WO2002086145A2 US7687280 US20040214896 US20040038925 US7649211 US4436819 US20050202341 WO2001061009A2 US6265170 US4665011 US20040054162 US20090182167 EP0891942A1 EP1594987B1 EP1954718A2 US20050079131 US7667017 EP1949100A1 US20020086882 WO2009103381A1 WO2006022639A1 EP2183205A1 US20030044933 WO1998044020A1 US7280787 US20100136072 US20090317539 EP0266194B1 EP2073799A2 US20020192217 US20090062517 EP0379905A1 EP1689705A2 EP0185048A1 US6319653 WO2002094910A1 EP0889751B1 US20060004154 WO2003042353A2 EP1365790A2 US7038041 US5780238 WO2003071355A2 US20060030019 US20100261187 US20040009924 US20040018516 EP1207816A1 WO2010121226A2 WO2009089508A1 WO2006026759A2 US7332302 WO2008107878A1 EP1937647A1 US20040194660 US20040138208 WO2008085991A2 WO2009127671A1 US20030224290 US20030192069 EP1606317B1 WO2010127318A2 US20090053649 EP1437595A1 US20050250824 US20090227533 US20070172429 WO2007147011A2 WO2007044303A2 EP1370686A2 EP1771579A2 US20040086856 WO2010075060A2 US20100061996 US7476904
Mcule MCULE-5722792423
MolPort MolPort-001-759-270
Nikkaji J2.978E
NMRShiftDB 74925
PubChem 9215
PubChem: Thomson Pharma 15195151
SureChEMBL SCHEMBL8339
ZINC ZINC08579950

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