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Name | CHEMBL343622 |
---|---|
Molecular formula | C31H30ClN2O4- |
IUPAC name | 2-[4-[(2-butyl-6-chloro-5-ethoxycarbonyl-4-phenyl-4H-pyrimidin-3-yl)methyl]phenyl]benzoate |
Molecular weight | 530.041 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 6.9 |
Synonyms | Sodium; 4''-(2-butyl-4-chloro-5-ethoxycarbonyl-6-phenyl-6H-pyrimidin-1-ylmethyl)-biphenyl-2-carboxylate BDBM50004159 |
Inchi Key | CXBDONQYBUGBPV-UHFFFAOYSA-M |
Inchi ID | InChI=1S/C31H31ClN2O4/c1-3-5-15-26-33-29(32)27(31(37)38-4-2)28(23-11-7-6-8-12-23)34(26)20-21-16-18-22(19-17-21)24-13-9-10-14-25(24)30(35)36/h6-14,16-19,28H,3-5,15,20H2,1-2H3,(H,35,36)/p-1 |
PubChem CID | 91928660 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50004159 |
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 |
---|---|---|---|---|---|
52642 | Type-1B angiotensin II receptor | P29089 | Agtr1b | Rattus norvegicus (Rat) | 359 |
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