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Name | CHEMBL412762 |
---|---|
Molecular formula | C33H35N3O5S |
IUPAC name | (3R)-N-[(4R)-7-(morpholin-4-ylmethyl)-3,4-dihydro-2H-chromen-4-yl]-3-(naphthalen-2-ylsulfonylamino)-3-phenylpropanamide |
Molecular weight | 585.719 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 4.0 |
Synonyms | BDBM50209743 (R)-N-((R)-7-(morpholinomethyl)chroman-4-yl)-3-(naphthalene-3-sulfonamido)-3-phenylpropanamide |
Inchi Key | AZKBBIWPORIMHR-FIRIVFDPSA-N |
Inchi ID | InChI=1S/C33H35N3O5S/c37-33(34-30-14-17-41-32-20-24(10-13-29(30)32)23-36-15-18-40-19-16-36)22-31(26-7-2-1-3-8-26)35-42(38,39)28-12-11-25-6-4-5-9-27(25)21-28/h1-13,20-21,30-31,35H,14-19,22-23H2,(H,34,37)/t30-,31-/m1/s1 |
PubChem CID | 16220918 |
ChEMBL | CHEMBL412762 |
IUPHAR | N/A |
BindingDB | 50209743 |
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 |
---|---|---|---|---|---|
18255 | B1 bradykinin receptor | P46663 | BDKRB1 | Homo sapiens (Human) | 353 |
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