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Name | CHEMBL1834619 |
---|---|
Molecular formula | C31H32ClN5O2 |
IUPAC name | 6-(8-chloro-4-methyl-1-oxophthalazin-2-yl)-N-[(1R)-6-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]pyridine-3-carboxamide |
Molecular weight | 542.08 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 4.9 |
Synonyms | BDBM50355063 |
Inchi Key | MZSXUPHOLCLGAB-HHHXNRCGSA-N |
Inchi ID | InChI=1S/C31H32ClN5O2/c1-20-24-8-6-9-26(32)29(24)31(39)37(35-20)28-14-12-23(18-33-28)30(38)34-27-10-5-7-22-17-21(11-13-25(22)27)19-36-15-3-2-4-16-36/h6,8-9,11-14,17-18,27H,2-5,7,10,15-16,19H2,1H3,(H,34,38)/t27-/m1/s1 |
PubChem CID | 56594769 |
ChEMBL | CHEMBL1834619 |
IUPHAR | N/A |
BindingDB | 50355063 |
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 |
---|---|---|---|---|---|
218136 | B1 bradykinin receptor | P48748 | BDKRB1 | Oryctolagus cuniculus (Rabbit) | 352 |
218137 | B1 bradykinin receptor | P46663 | BDKRB1 | Homo sapiens (Human) | 353 |
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