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Name | CHEMBL545019 |
---|---|
Molecular formula | C29H34Cl2N2O3 |
IUPAC name | 2-[1-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]-4-phenylbutan-2-yl]oxyacetic acid;hydrochloride |
Molecular weight | 529.502 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | None |
Synonyms | N/A |
Inchi Key | VUBLFAUFFUJLQE-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H33ClN2O3.ClH/c30-26-14-12-25(13-15-26)29(24-9-5-2-6-10-24)32-19-17-31(18-20-32)21-27(35-22-28(33)34)16-11-23-7-3-1-4-8-23;/h1-10,12-15,27,29H,11,16-22H2,(H,33,34);1H |
PubChem CID | 45261079 |
ChEMBL | CHEMBL545019 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
364329 | B2 bradykinin receptor | P25023 | Bdkrb2 | Rattus norvegicus (Rat) | 396 |
364328 | Histamine H1 receptor | P31389 | HRH1 | Cavia porcellus (Guinea pig) | 488 |
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