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Name | CHEMBL65161 |
---|---|
Molecular formula | C29H31NO3S |
IUPAC name | (Z)-7-[(2S,3S,4S)-4-[(4-phenylphenyl)methoxy]-2-pyridin-3-ylthiolan-3-yl]hept-5-enoic acid |
Molecular weight | 473.631 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 5.5 |
Synonyms | BDBM50283045 (Z)-7-[(2S,3S,4S)-4-(Biphenyl-4-ylmethoxy)-2-pyridin-3-yl-tetrahydro-thiophen-3-yl]-hept-5-enoic acid |
Inchi Key | AVFPODQCTNAKHD-BTOVUEFMSA-N |
Inchi ID | InChI=1S/C29H31NO3S/c31-28(32)13-7-2-1-6-12-26-27(21-34-29(26)25-11-8-18-30-19-25)33-20-22-14-16-24(17-15-22)23-9-4-3-5-10-23/h1,3-6,8-11,14-19,26-27,29H,2,7,12-13,20-21H2,(H,31,32)/b6-1-/t26-,27+,29+/m0/s1 |
PubChem CID | 44305452 |
ChEMBL | CHEMBL65161 |
IUPHAR | N/A |
BindingDB | 50283045 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
15254 | Thromboxane A2 receptor | P21731 | TBXA2R | Homo sapiens (Human) | 343 |
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