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Name | MLS002245100 |
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Molecular formula | C19H21ClN4O3 |
IUPAC name | N-[2-(2-chloroanilino)-2-oxoethyl]-N-methyl-3-(phenylcarbamoylamino)propanamide |
Molecular weight | 388.852 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 3 |
XlogP | 1.9 |
Synonyms | 3-[[anilino(oxo)methyl]amino]-N-[2-(2-chloroanilino)-2-oxoethyl]-N-methylpropanamide HMS3044I22 SMR001308765 AKOS033969619 MolPort-004-153-983 [ Show all ] |
Inchi Key | BWBWSSQSBXNODV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H21ClN4O3/c1-24(13-17(25)23-16-10-6-5-9-15(16)20)18(26)11-12-21-19(27)22-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H,23,25)(H2,21,22,27) |
PubChem CID | 16292840 |
ChEMBL | CHEMBL1699232 |
IUPHAR | N/A |
BindingDB | 96816 |
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 |
---|---|---|---|---|---|
467134 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
34316 | Trace amine-associated receptor 1 | Q96RJ0 | TAAR1 | Homo sapiens (Human) | 339 |
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