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Name | Talnetant |
---|---|
Molecular formula | C25H22N2O2 |
IUPAC name | 3-hydroxy-2-phenyl-N-[(1S)-1-phenylpropyl]quinoline-4-carboxamide |
Molecular weight | 382.463 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 5.7 |
Synonyms | SCHEMBL74220 (S)-(-)-N-(R-ethylbenzyl)-3-hydroxy-2-phenylquinoline-4-carboxamide 3-Hydroxy-2-phenyl-quinoline-4-carboxylic acid ((S)-1-phenyl-propyl)-amide AKOS024458283 CZ3T9T146K [ Show all ] |
Inchi Key | BIAVGWDGIJKWRM-FQEVSTJZSA-N |
Inchi ID | InChI=1S/C25H22N2O2/c1-2-20(17-11-5-3-6-12-17)27-25(29)22-19-15-9-10-16-21(19)26-23(24(22)28)18-13-7-4-8-14-18/h3-16,20,28H,2H2,1H3,(H,27,29)/t20-/m0/s1 |
PubChem CID | 5311424 |
ChEMBL | CHEMBL10188 |
IUPHAR | 2132 |
BindingDB | 50051293 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
442612 | Adenosine receptor A1 | P30542 | ADORA1 | Homo sapiens (Human) | 326 |
442614 | Adenosine receptor A3 | P0DMS8 | ADORA3 | Homo sapiens (Human) | 318 |
442610 | Gastrin/cholecystokinin type B receptor | P32239 | CCKBR | Homo sapiens (Human) | 447 |
442613 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
24272 | Mu-type opioid receptor | P35372 | OPRM1 | Homo sapiens (Human) | 400 |
24267 | Neuromedin-K receptor | P29371 | TACR3 | Homo sapiens (Human) | 465 |
24268 | Neuromedin-K receptor | P30098 | TACR3 | Cavia porcellus (Guinea pig) | 440 |
24271 | Neuromedin-K receptor | P16177 | Tacr3 | Rattus norvegicus (Rat) | 452 |
442611 | Prostaglandin E2 receptor EP4 subtype | P35408 | PTGER4 | Homo sapiens (Human) | 488 |
24270 | Substance-K receptor | P21452 | TACR2 | Homo sapiens (Human) | 398 |
24269 | Substance-P receptor | P25103 | TACR1 | Homo sapiens (Human) | 407 |
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