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Name | FK 888 |
---|---|
Molecular formula | C36H36N4O4 |
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 weight | 588.708 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 4.6 |
Synonyms | MolPort-023-276-412 BRD-K83508485-001-01-9 GTPL2114 PDSP2_000648 (4R)-4-Hydroxy-1-[(1-methyl-1H-indol-3-yl)carbonyl]-L-prolyl-N-methyl-3-(2-naphthalenyl)-N-(phenylmethyl)-L-alaninamide [ Show all ] |
Inchi Key | BFNKQTIJVFGCKQ-PDJGWCFMSA-N |
Inchi ID | InChI=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 CID | 107967 |
ChEMBL | N/A |
IUPHAR | 2114 |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
553347 | Substance-K receptor | P21452 | TACR2 | Homo sapiens (Human) | 398 |
553346 | Substance-P receptor | P25103 | TACR1 | Homo sapiens (Human) | 407 |
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