General Information of the Compound
| Compound ID |
CP0016322
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| Compound Name |
6-chloro-2-methoxy-9-acridinyl(4-diethylamino-1-methylbutyl)amine
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| Synonyms |
2-Methoxy-6-chloro-9-diethylaminopentylaminoacridine
3-Chloro-7-methoxy-9-(1-methyl-4-diethylaminobutylamino)acridine
83-89-6
Acrinamine
Acriquine
Akrichin
Antimalarina
Atebrine
Erion
HSDB 3253
Haffkinine
Italchin
Italchine
Malaricida
Mecryl
Mepacrina [INN-Spanish]
Mepacrine
Mepacrine [INN:BAN]
Mepacrinum
Mepacrinum [INN-Latin]
Methoquine
Metochin
Palacrin
Palusan
Pentilen
Quinacrine hydrochloride
Quinacrine, Mepacrine
Quinactine
St 439
acrichine
atabrine
atebrin
mepacrine
quinacrine
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| Structure |
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| Formula |
C23H30ClN3O
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| Molecular Weight |
399.966
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| Canonical SMILES |
CCN(CC)CCCC(C)Nc1c2ccc(Cl)cc2nc2ccc(OC)cc12
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| InChI |
InChI=1S/C23H30ClN3O/c1-5-27(6-2)13-7-8-16(3)25-23-19-11-9-17(24)14-22(19)26-21-12-10-18(28-4)15-20(21)23/h9-12,14-16H,5-8,13H2,1-4H3,(H,25,26)
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| InChIKey |
GPKJTRJOBQGKQK-UHFFFAOYSA-N
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| CAS |
83-89-6
66777-81-9
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00820, Acetylcholinesterase
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT02591, Major prion protein
Protein ID: PT01065, Serine/threonine-protein kinase mTOR
Clinical Information about the Compound