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Ligand

NameCHEMBL214461
Molecular formulaC40H41F3N4O5
IUPAC name(2R)-N-[(3-aminophenyl)methyl]-1-[(2S)-1-(3,3,3-triphenylpropanoyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide;2,2,2-trifluoroacetic acid
Molecular weight714.786
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogPNone
SynonymsN/A
Inchi KeyAAAGJCMYVIZUAW-VBAOBBRWSA-N
Inchi IDInChI=1S/C38H40N4O3.C2HF3O2/c39-32-20-10-13-28(25-32)27-40-36(44)33-21-11-24-42(33)37(45)34-22-12-23-41(34)35(43)26-38(29-14-4-1-5-15-29,30-16-6-2-7-17-30)31-18-8-3-9-19-31;3-2(4,5)1(6)7/h1-10,13-20,25,33-34H,11-12,21-24,26-27,39H2,(H,40,44);(H,6,7)/t33-,34+;/m1./s1
PubChem CID16086050
ChEMBLCHEMBL214461
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
8Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590

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