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Name | NSC-309874 |
---|---|
Molecular formula | C26H23ClN2OS |
IUPAC name | 3-chloro-N-[2-[[(1S)-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenyl]-1-benzothiophene-2-carboxamide |
Molecular weight | 446.993 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 6.6 |
Synonyms | AC1MMYUE ZINC29590275 CHEMBL1525179 NCGC00097800-01 CCG-37878 [ Show all ] |
Inchi Key | ACKAQJBYLPLIOW-QFIPXVFZSA-N |
Inchi ID | InChI=1S/C26H23ClN2OS/c1-29-15-14-17-8-2-4-10-19(17)22(29)16-18-9-3-6-12-21(18)28-26(30)25-24(27)20-11-5-7-13-23(20)31-25/h2-13,22H,14-16H2,1H3,(H,28,30)/t22-/m0/s1 |
PubChem CID | 3246616 |
ChEMBL | CHEMBL1525179 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
1652 | Thyrotropin receptor | P16473 | TSHR | Homo sapiens (Human) | 764 |
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