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Name | UPCMLD04ASTW002105 |
---|---|
Molecular formula | C28H31N3O3 |
IUPAC name | benzyl N-[(S)-[(1S,2R)-1-methyl-2-[(2R)-1-oxo-1-(pyridin-2-ylmethylamino)propan-2-yl]cyclopropyl]-phenylmethyl]carbamate |
Molecular weight | 457.574 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 4.3 |
Synonyms | MLS000563762 benzyl N-[(S)-[(1S,2R)-1-methyl-2-[(2R)-1-oxo-1-(pyridin-2-ylmethylamino)propan-2-yl]cyclopropyl]-phenylmethyl]carbamate SDCCGMLS-0091055.P001 CMLD4_000069 MLS003180896 [ Show all ] |
Inchi Key | AHRCPCLEXQYEJS-PFCXFHTISA-N |
Inchi ID | InChI=1S/C28H31N3O3/c1-20(26(32)30-18-23-15-9-10-16-29-23)24-17-28(24,2)25(22-13-7-4-8-14-22)31-27(33)34-19-21-11-5-3-6-12-21/h3-16,20,24-25H,17-19H2,1-2H3,(H,30,32)(H,31,33)/t20-,24-,25-,28+/m1/s1 |
PubChem CID | 3247279 |
ChEMBL | CHEMBL1453137 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
5816 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
5815 | Thyrotropin receptor | P16473 | TSHR | Homo sapiens (Human) | 764 |
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