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Ligand

NameFK 888
Molecular formulaC36H36N4O4
IUPAC name(2S,4R)-N-[(2S)-1-[benzyl(methyl)amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-4-hydroxy-1-(1-methylindole-3-carbonyl)pyrrolidine-2-carboxamide
Molecular weight588.708
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.6
Synonyms(4R)-4-Hydroxy-1-[(1-methyl-1H-indol-3-yl)carbonyl]-L-prolyl-N-methyl-3-(2-naphthalenyl)-N-(phenylmethyl)-L-alaninamide
D05UKK
L-Alaninamide, trans-4-hydroxy-1-((1-methyl-1H-indol-3-yl)carbonyl)-L-prolyl-N-methyl-3-(2-naphthalenyl)-N-(phenylmethyl)-
AC1L332N
FK-888
[ Show all ]
Inchi KeyBFNKQTIJVFGCKQ-PDJGWCFMSA-N
Inchi IDInChI=1S/C36H36N4O4/c1-38-23-30(29-14-8-9-15-32(29)38)35(43)40-22-28(41)20-33(40)34(42)37-31(36(44)39(2)21-24-10-4-3-5-11-24)19-25-16-17-26-12-6-7-13-27(26)18-25/h3-18,23,28,31,33,41H,19-22H2,1-2H3,(H,37,42)/t28-,31+,33+/m1/s1
PubChem CID107967
ChEMBLN/A
IUPHAR2114
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
553347Substance-K receptorP21452TACR2Homo sapiens (Human)398
553346Substance-P receptorP25103TACR1Homo sapiens (Human)407

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