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Name | SMR000107691 |
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Molecular formula | C22H17FN4O3 |
IUPAC name | 5-[(3-fluorobenzoyl)amino]-N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide |
Molecular weight | 404.401 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 3.6 |
Synonyms | AC1LLJ7B BRD-K10637864-001-01-5 MCULE-5179246556 CBMicro_016287 MolPort-002-190-940 [ Show all ] |
Inchi Key | AEJPPJWLDYNVNO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H17FN4O3/c23-16-7-4-6-15(12-16)21(28)26-20-19(22(29)24-13-18-10-5-11-30-18)14-25-27(20)17-8-2-1-3-9-17/h1-12,14H,13H2,(H,24,29)(H,26,28) |
PubChem CID | 1068291 |
ChEMBL | CHEMBL1362135 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
3541 | Thyrotropin receptor | P16473 | TSHR | Homo sapiens (Human) | 764 |
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