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Name | CHEMBL130607 |
---|---|
Molecular formula | C34H31F2N5O4 |
IUPAC name | ethyl 8-cyano-1-[(2,6-difluorophenyl)methyl]-7-(4-methoxyphenyl)-6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-4-oxopyrrolo[1,2-a]pyrimidine-3-carboxylate |
Molecular weight | 611.65 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 0 |
XlogP | 5.1 |
Synonyms | 8-Cyano-1-(2,6-difluoro-benzyl)-7-(4-methoxy-phenyl)-6-{[methyl-(2-pyridin-2-yl-ethyl)-amino]-methyl}-4-oxo-1,4-dihydro-pyrrolo[1,2-a]pyrimidine-3-carboxylic acid ethyl ester 1-(2,6-Difluorobenzyl)-4-oxo-6-[methyl[2-(2-pyridinyl)ethyl]aminomethyl]-7-(4-methoxyphenyl)-8-cyano-1,4-dihydropyrrolo[1,2-a]pyrimidine-3-carboxylic acid ethyl ester BDBM50109214 |
Inchi Key | AEDNDIPRPKKLJV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C34H31F2N5O4/c1-4-45-34(43)27-20-40(19-26-28(35)9-7-10-29(26)36)32-25(18-37)31(22-11-13-24(44-3)14-12-22)30(41(32)33(27)42)21-39(2)17-15-23-8-5-6-16-38-23/h5-14,16,20H,4,15,17,19,21H2,1-3H3 |
PubChem CID | 44352801 |
ChEMBL | CHEMBL130607 |
IUPHAR | N/A |
BindingDB | 50109214 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
3366 | Gonadotropin-releasing hormone receptor | P30968 | GNRHR | Homo sapiens (Human) | 328 |
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