Makaluvamine N

Details

Top
Internal ID fb87c4f6-cfdb-4d62-a722-2b46c0ecb46b
Taxonomy Organoheterocyclic compounds > Quinolines and derivatives > Aminoquinolines and derivatives
IUPAC Name 10-amino-9-bromo-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(11),2,4(12),7,9-pentaen-11-ol
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C10H8BrN3O/c11-6-7(12)10(15)9-5-4(3-14-9)1-2-13-8(5)6/h3,15H,1-2,12H2
InChI Key UMVGTIHJQQYCQI-UHFFFAOYSA-N
Popularity 3 references in papers

Physical and Chemical Properties

Top
Molecular Formula C10H8BrN3O
Molecular Weight 266.09 g/mol
Exact Mass 264.98507 g/mol
Topological Polar Surface Area (TPSA) 71.00 Ų
XlogP -0.50

Synonyms

Top
There are no found synonyms.

2D Structure

Top
2D Structure of Makaluvamine N

3D Structure

Top

ADMET Properties (via admetSAR 2)

Top
Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

Top

Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 96.16% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 92.52% 96.09%
CHEMBL3137262 O60341 LSD1/CoREST complex 90.56% 97.09%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 84.25% 95.56%
CHEMBL241 Q14432 Phosphodiesterase 3A 84.13% 92.94%
CHEMBL5608 Q16288 NT-3 growth factor receptor 83.91% 95.89%
CHEMBL3438 Q05513 Protein kinase C zeta 83.12% 88.48%
CHEMBL3713062 P10646 Tissue factor pathway inhibitor 81.17% 97.33%
CHEMBL1293255 P15428 15-hydroxyprostaglandin dehydrogenase [NAD+] 80.57% 83.57%
CHEMBL1907594 P30926 Neuronal acetylcholine receptor; alpha3/beta4 80.12% 97.23%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 80.05% 94.00%

Plants that contains it

Top
Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
There are no matching plants.

Cross-Links

Top
PubChem 135496970
LOTUS LTS0118444
wikiData Q105275759