General Information of the Compound
| Compound ID |
CP0308131
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| Compound Name |
9,13b-dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amine
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| Synonyms |
(+-)-Epinastine
3-Amino-9,13b-dihydro-1H-dibenz(c,f)imidazo(1,5-a)azepine
3-amino-9,13b-dihydro-1H-benz(c,f)imidazo(1,5a)azepine
9,13b-dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amine
Elestat (TN)
Epinastina
Epinastina [Spanish]
Epinastine
Epinastine (INN)
Epinastine [INN]
Epinastinum
Epinastinum [Latin]
Purivist
Purivist (TN)
Relestat (TN)
WAL 80
WAL 801
WAL 801CL
WAL-80 Cl
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| Structure |
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| Formula |
C16H15N3
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| Molecular Weight |
249.317
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| Canonical SMILES |
NC1=NCC2N1c1ccccc1Cc1ccccc21
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| InChI |
InChI=1S/C16H15N3/c17-16-18-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)19(15)16/h1-8,15H,9-10H2,(H2,17,18)
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| InChIKey |
WHWZLSFABNNENI-UHFFFAOYSA-N
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| CAS |
134507-59-8
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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: PT05367, Multidrug and toxin extrusion protein 1
Protein ID: PT05330, Multidrug and toxin extrusion protein 2
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2
Protein ID: PT04591, Solute carrier family 22 member 2
Clinical Information about the Compound