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Ligand

NameCHEMBL441115
Molecular formulaC32H40N4O4
IUPAC name(2S)-N-(3-morpholin-4-ylpropyl)-3-phenyl-2-[[4-(4-propan-2-ylphenoxy)phenyl]carbamoylamino]propanamide
Molecular weight544.696
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP4.9
Synonyms(S)-2-{3-[4-(4-Isopropyl-phenoxy)-phenyl]-ureido}-N-(3-morpholin-4-yl-propyl)-3-phenyl-propionamide
BDBM50159873
Inchi KeyAKCNXMUAPPMEEU-PMERELPUSA-N
Inchi IDInChI=1S/C32H40N4O4/c1-24(2)26-9-13-28(14-10-26)40-29-15-11-27(12-16-29)34-32(38)35-30(23-25-7-4-3-5-8-25)31(37)33-17-6-18-36-19-21-39-22-20-36/h3-5,7-16,24,30H,6,17-23H2,1-2H3,(H,33,37)(H2,34,35,38)/t30-/m0/s1
PubChem CID44390553
ChEMBLCHEMBL441115
IUPHARN/A
BindingDB50159873
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
7432Substance-K receptorP21452TACR2Homo sapiens (Human)398

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