You can:
Name | CHEMBL355387 |
---|---|
Molecular formula | C33H37FN2O6S |
IUPAC name | [(5R)-5-(4-fluorophenyl)-5-[2-(2-oxospiro[1H-2-benzothiophene-3,4'-piperidine]-1'-yl)ethyl]-1,3-oxazolidin-3-yl]-(3,4,5-trimethoxyphenyl)methanone |
Molecular weight | 608.725 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 0 |
XlogP | 3.6 |
Synonyms | 1'-[2-[(5R)-3-(3,4,5-Trimethoxybenzoyl)-5-(4-fluorophenyl)-5alpha-oxazolidinyl]ethyl]spiro[benzo[c]thiophene-1(3H),4'-piperidine]2-oxide BDBM50217510 |
Inchi Key | GAIQLSPNSILBOM-HYXMPAGBSA-N |
Inchi ID | InChI=1S/C33H37FN2O6S/c1-39-28-18-24(19-29(40-2)30(28)41-3)31(37)36-21-32(42-22-36,25-8-10-26(34)11-9-25)12-15-35-16-13-33(14-17-35)27-7-5-4-6-23(27)20-43(33)38/h4-11,18-19H,12-17,20-22H2,1-3H3/t32-,43?/m0/s1 |
PubChem CID | 44382140 |
ChEMBL | CHEMBL355387 |
IUPHAR | N/A |
BindingDB | 50217510 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
91653 | Substance-K receptor | Q64077 | TACR2 | Cavia porcellus (Guinea pig) | 402 |
91654 | Substance-P receptor | P30547 | TACR1 | Cavia porcellus (Guinea pig) | 407 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417