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Name | AC1M6DCN |
---|---|
Molecular formula | C18H17ClN2O4S |
IUPAC name | [2-(3-chloroanilino)-2-oxoethyl] (2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate |
Molecular weight | 392.854 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 3.4 |
Synonyms | SMR001316753 [(3-chlorophenyl)carbamoyl]methyl (2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate CHEMBL1878436 MLS002249315 Z56828619 [ Show all ] |
Inchi Key | ABYFEIMATKQJKP-AWEZNQCLSA-N |
Inchi ID | InChI=1S/C18H17ClN2O4S/c19-12-4-1-5-13(10-12)20-16(22)11-25-18(24)14-6-2-8-21(14)17(23)15-7-3-9-26-15/h1,3-5,7,9-10,14H,2,6,8,11H2,(H,20,22)/t14-/m0/s1 |
PubChem CID | 2346593 |
ChEMBL | CHEMBL1878436 |
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 |
---|---|---|---|---|---|
463117 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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