WHC is still in active development. Read this to understand our approach.
depiction of RERZNCLIYCABFS-UHFFFAOYSA-N.svg
isomerdesign

Harmaline

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pubchem

Harmaline

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wiki

Harmaline

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Data

InChI: InChI=1S/C13H14N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-4,7,15H,5-6H2,1-2H3

Synonyms: A1-00783,DB13875,Prestwick3_000610,A820367,7-METHOXY-1-METHYL-4,9-DIHYDRO-3H-PYRIDO(3,4-B)INDOLE,304-21-2,DivK1c_000950,HMS2233L23,NCGC00017221-04,HARMALINE [HSDB],SMR000058221,3H-Pyrido(3,4-b)indole, 4,9-dihydro-7-methoxy-1-methyl-,NCGC00017221-03,1-Methyl-7-methoxy-3,4-dihydro- beta-carboline,FT-0626855,NINDS_000950,SR-01000721899-5,3,4-Dihydro-7-methoxy-1-methyl-9-pyrid(3,4-b)indole,WLN: T B656 DM HM CHJ F1 KO1,HMS3371G17,7-Methoxy-1-methyl-4,9-dihydro-3H-?-carboline,AC-34436,NCGC00017221-02,7-methoxy-1-methyl-3,4-dihydro-2h-beta-carboline,BIDD:ER0444,NSC-407285,NSC 407285,DB-047778,BRD-K91317041-310-03-3,SR-01000721899-4,STL570451,Oprea1_112644,KBioSS_000781,7-methoxy-1-methyl-2H,3H,4H-pyrido[3,4-b]indole,EINECS 206-152-6,CHEBI:28172,Prestwick2_000610,SPBio_002739,7-Methoxy-1-methyl-2,9-dihydro-1H-beta-carboline,HARMALINE [MI],KS-5325,BRN 0207310,IDI1_000950,HSDB 7645,3H-Pyrido[3,4-b]indole, 4,9-dihydro-7-methoxy-1-methyl-,4,9-Dihydro-7-methoxy-1-methyl-3H-pyrido[3,4-b]indole,NCGC00017221-05,NCGC00017221-06,NCGC00094867-05,KBio2_000781,Prestwick1_000610,Armalin,BSPBio_002539,MLS000028746,KBio1_000950,DTXSID8041038,3,4-Dihydroharmin,BPBio1_000572,NSC407285,KBio2_003349,3H-Pyrido[3, 4,9-dihydro-7-methoxy-1-methyl-,KBioGR_001367,CS-0030704,Harmalol methyl ether,3,4-Dihydro-7-methoxy-1-methyl-9H-pyrid[3,4-b]indole,Dihydroharmine,CCG-38677,KBio3_001759,Spectrum4_000824,NSC-789037,Opera_ID_665,Prestwick0_000610,H-1102,7-Methoxyharmalan,NCGC00094867-03,NCGC00094867-01,AKOS026750619,1-Methyl-7-methoxy-3,4-dihydro-.beta.-carboline,Harmidine,MFCD00004955,NCGC00094867-04,β-Carboline, 3,4-dihydro-7-methoxy-1-methyl,4,9-Dihydro-7-methoxy-1-methyl-3H-pyrido(3,4-b)indole,HMS502P12,ZINC100014157,3,4-Dihydro-7-methoxy-1-methyl-beta-carboline,harmalin,Spectrum3_000720,s4776,Spectrum_000301,SCHEMBL199260,7-Methoxy-1-methyl-4,9-dihydro-3H-beta-carboline,NSC789037,HY-107828,7-methoxy-1-methyl-3,4-dihydrobeta-carboline,CN58I4TOET,NCGC00094867-06,Dihydro-Harmine,NCGC00094867-02,7-Methoxy-1-methyl-4,9-dihydro-3H-beta-carboline #,SPBio_000362,3,4-Dihydro-7-methoxy-1-methyl-9-pyrid[3,4-b]indole,TNP00101,3, 4-Dihydroharmine,NCGC00017221-01,Harmine, dihydro-,harmaline,7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole,Spectrum2_000411,ZINC12496083,1-Methyl-7-methoxy-3,4-dihydro-beta-carboline,BSPBio_000520,3,4-Dihydro-7-methoxy-1-methyl-b-carboline,H1237,H-1100,BDBM50029799,7-methoxy-1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole,SR-01000721899,BRD-K91317041-001-03-8,7-methoxy-1-methyl-4,9-dihydro-3H-b-carboline,1-Methyl-7-methoxy-3,4-dihydro-beta -carboline,Q135270,3,4-Dihydro-7-methoxy-1-methyl-β-carboline,CHEBI:95328,AKOS015904564,NCGC00017221-07,3,4-Dihydro-7-methoxy-1-methyl-9H-pyrido[3,4-b]indole,CHEMBL340807,3,4-Dihydroharmine,HMS3885P22,MLS001148231,MEGxp0_001874,KBio2_005917,Spectrum5_001452,Harmadine,LS-14204,Harmaline,3,4-Dihydro-7-methoxy-1-methyl-9-pyrido(3,4-b)indole,HARMALINE [MART.],3,4-b]indole,ACon1_000019,SDCCGMLS-0066716.P001,HMS1921K22,1-Methyl-7-methoxy-3, 4-dihydro-beta -carboline,O-Methylharmalol,SPECTRUM1500864,UNII-CN58I4TOET,SCHEMBL3862598,C06536


Estimated data

Solubility: -3.678 (log(S) in mol/L prediction using SolTranNet)

Blood Brain Barrier Permeability: Yes (prediction using frontiersin.org)

Addictivity Prediction: 73.4% (prediction based on www.mdpi.com)

Similarities

The following is a set of comparisons to understand the properties of this compound. This is still higly experimental and is still under active development. Please refer to our series of blog posts to fully understand our approach and its limitations. This information is for informational purposes only and should not be construed as medical advice.