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Name | AC1OC89K |
---|---|
Molecular formula | C12H9Cl2N3OS |
IUPAC name | [(E)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]thiourea |
Molecular weight | 314.184 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 3.5 |
Synonyms | AB00074642-01 SCHEMBL12417171 BAS 00246727 MLS000525770 SMR000116244 [ Show all ] |
Inchi Key | ADXFRNKHMYIVPJ-OMCISZLKSA-N |
Inchi ID | InChI=1S/C12H9Cl2N3OS/c13-7-1-3-10(14)9(5-7)11-4-2-8(18-11)6-16-17-12(15)19/h1-6H,(H3,15,17,19)/b16-6+ |
PubChem CID | 6896701 |
ChEMBL | CHEMBL3193305 |
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 |
---|---|---|---|---|---|
3203 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
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