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Name | CHEMBL2035982 |
---|---|
Molecular formula | C30H28F2N6O3 |
IUPAC name | 2-[(8R)-8-(3,5-difluorophenyl)-10-oxo-6,9-diazaspiro[4.5]decan-9-yl]-N-[(3S)-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-3'-yl]acetamide |
Molecular weight | 558.59 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 3 |
XlogP | 1.7 |
Synonyms | BDBM50385313 |
Inchi Key | GFOFSWUKCXORBM-OUTSHDOLSA-N |
Inchi ID | InChI=1S/C30H28F2N6O3/c31-19-8-17(9-20(32)11-19)24-15-35-30(5-1-2-6-30)28(41)38(24)16-25(39)36-21-10-18-12-29(13-23(18)34-14-21)22-4-3-7-33-26(22)37-27(29)40/h3-4,7-11,14,24,35H,1-2,5-6,12-13,15-16H2,(H,36,39)(H,33,37,40)/t24-,29-/m0/s1 |
PubChem CID | 70692303 |
ChEMBL | CHEMBL2035982 |
IUPHAR | N/A |
BindingDB | 50385313 |
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 |
---|---|---|---|---|---|
95214 | Calcitonin gene-related peptide type 1 receptor | Q63118 | Calcrl | Rattus norvegicus (Rat) | 464 |
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