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Name | MLS-0437448.0001 |
---|---|
Molecular formula | C11H11N5S |
IUPAC name | [(E)-(5-phenyl-1H-pyrazol-4-yl)methylideneamino]thiourea |
Molecular weight | 245.304 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 3 |
XlogP | 1.2 |
Synonyms | CHEMBL1701030 [[(E)-(3-phenylpyrazol-4-ylidene)methyl]amino]thiourea AC1NTZ84 {[(1E)-2-(3-phenylpyrazol-4-yl)-1-azavinyl]amino}aminomethane-1-thione (2E)-2-[(3-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinecarbothioamide [ Show all ] |
Inchi Key | CNUFVDRGRFSWEU-VGOFMYFVSA-N |
Inchi ID | InChI=1S/C11H11N5S/c12-11(17)16-14-7-9-6-13-15-10(9)8-4-2-1-3-5-8/h1-7H,(H,13,15)(H3,12,16,17)/b14-7+ |
PubChem CID | 135446678 |
ChEMBL | CHEMBL1701030 |
IUPHAR | N/A |
BindingDB | 75871 |
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 |
---|---|---|---|---|---|
558711 | G-protein coupled receptor 35 | Q9HC97 | GPR35 | Homo sapiens (Human) | 309 |
558710 | G-protein coupled receptor 55 | Q9Y2T6 | GPR55 | Homo sapiens (Human) | 319 |
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