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Ligand

NameCHEMBL74594
Molecular formulaC20H29N5O
IUPAC name1-[(E)-[5-(3-methylbut-2-enoxy)-1H-indol-3-yl]methylideneamino]-2-pentylguanidine
Molecular weight355.486
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP4.1
SynonymsBDBM50453700
Inchi KeyBSTFUTCMSPDNRH-ZVHZXABRSA-N
Inchi IDInChI=1S/C20H29N5O/c1-4-5-6-10-22-20(21)25-24-14-16-13-23-19-8-7-17(12-18(16)19)26-11-9-15(2)3/h7-9,12-14,23H,4-6,10-11H2,1-3H3,(H3,21,22,25)/b24-14+
PubChem CID135500023
ChEMBLCHEMBL74594
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 5
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GLASS IDNameUniProtGeneSpeciesLength
5582595-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
5582565-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
5582585-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
5582575-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
5582605-hydroxytryptamine receptor 4O70528HTR4Cavia porcellus (Guinea pig)388

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