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Name | CHEMBL53803 |
---|---|
Molecular formula | C33H35N7O2 |
IUPAC name | 2-butyl-6-[(3R)-2-methyl-3,3a,4,5,6,6a-hexahydrocyclopenta[d][1,2]oxazol-3-yl]-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]quinazolin-4-one |
Molecular weight | 561.69 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 5.4 |
Synonyms | BDBM50282879 2-Butyl-6-((R)-2-methyl-hexahydro-cyclopenta[d]isoxazol-3-yl)-3-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-quinazolin-4-one |
Inchi Key | HFSBXIQXFLGAIT-RKQLGKQKSA-N |
Inchi ID | InChI=1S/C33H35N7O2/c1-3-4-12-30-34-28-18-17-23(31-26-10-7-11-29(26)42-39(31)2)19-27(28)33(41)40(30)20-21-13-15-22(16-14-21)24-8-5-6-9-25(24)32-35-37-38-36-32/h5-6,8-9,13-19,26,29,31H,3-4,7,10-12,20H2,1-2H3,(H,35,36,37,38)/t26?,29?,31-/m0/s1 |
PubChem CID | 44296953 |
ChEMBL | CHEMBL53803 |
IUPHAR | N/A |
BindingDB | 50282879 |
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 |
---|---|---|---|---|---|
113720 | Type-1 angiotensin II receptor | P25104 | AGTR1 | Bos taurus (Bovine) | 359 |
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