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Name | CHEMBL33589 |
---|---|
Molecular formula | C23H22N2O5 |
IUPAC name | propan-2-yl (2S)-2-(naphthalene-1-carbonylamino)-3-(4-nitrophenyl)propanoate |
Molecular weight | 406.438 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 5.0 |
Synonyms | BDBM50100037 N-(1-Naphthylcarbonyl)-4-nitro-L-phenylalanine isopropyl ester (S)-2-[(Naphthalene-1-carbonyl)-amino]-3-(4-nitro-phenyl)-propionic acid isopropyl ester SCHEMBL3929560 |
Inchi Key | BRRSSHDHRPOLFQ-NRFANRHFSA-N |
Inchi ID | InChI=1S/C23H22N2O5/c1-15(2)30-23(27)21(14-16-10-12-18(13-11-16)25(28)29)24-22(26)20-9-5-7-17-6-3-4-8-19(17)20/h3-13,15,21H,14H2,1-2H3,(H,24,26)/t21-/m0/s1 |
PubChem CID | 44281791 |
ChEMBL | CHEMBL33589 |
IUPHAR | N/A |
BindingDB | 50100037 |
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 |
---|---|---|---|---|---|
31290 | C-C chemokine receptor type 3 | P51677 | CCR3 | Homo sapiens (Human) | 355 |
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