None

AlkaPlorer ID: AK324918

Synonym: None

IUPAC Name: 8-bromo-4,5,5-trimethyl-6H-benzo[c][2,7]naphthyridine

Structure

SMILES: CC1=C2C(=CC=N1)C1=CC=C(Br)C=C1NC2(C)C

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InChI: InChI=1S/C15H15BrN2/c1-9-14-12(6-7-17-9)11-5-4-10(16)8-13(11)18-15(14,2)3/h4-8,18H,1-3H3

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InChIKey: YBGLIPYAJPOYAD-UHFFFAOYSA-N

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Reference

PubChem CID: 25235287

NPASS: NPC489874

Source

Species Genus Family Order Class Phylum Kingdom Domain
Verongula rigida Verongula Aplysinidae Verongiida Demospongiae Porifera Metazoa Eukaryota

Properties Information

Molecule Weight: 303.20300000000003

TPSA: 24.92

MolLogP: 4.480120000000003

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens Alpha-1a adrenergic receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Alpha-1b adrenergic receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Alpha-2a adrenergic receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Alpha-2b adrenergic receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Alpha-2c adrenergic receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Beta-1 adrenergic receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Delta opioid receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Dopamine D1 receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Dopamine D2 receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Dopamine D3 receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Dopamine D4 receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Dopamine D5 receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Dopamine transporter Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Histamine H1 receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Histamine H2 receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Histamine H3 receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Histamine H4 receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Kappa opioid receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Mu opioid receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Muscarinic acetylcholine receptor M1 Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Muscarinic acetylcholine receptor M2 Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Muscarinic acetylcholine receptor M3 Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Muscarinic acetylcholine receptor M4 Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Muscarinic acetylcholine receptor M5 Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Norepinephrine transporter Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin 1a (5-HT1a) receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin 1b (5-HT1b) receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin 1d (5-HT1d) receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin 1e (5-HT1e) receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin 2a (5-HT2a) receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin 2b (5-HT2b) receptor Ki 390.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin 2c (5-HT2c) receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin 3a (5-HT3a) receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin 5a (5-HT5a) receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin 6 (5-HT6) receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin 7 (5-HT7) receptor Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Serotonin transporter Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Sigma intracellular receptor 2 Ki 10000.0 nM 10.1021/acs.jnatprod.9b01107
Homo sapiens Sigma opioid receptor Ki 560.0 nM 10.1021/acs.jnatprod.9b01107
Mus musculus Mus musculus Activity nan None 10.1021/acs.jnatprod.9b01107
None ADMET Activity nan None 10.1021/acs.jnatprod.9b01107

Metabolism Information