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Name | SMR000172889 |
---|---|
Molecular formula | C28H31N3O4 |
IUPAC name | N-cyclohexyl-2-[furan-2-ylmethyl-[2-(1H-indol-3-yl)acetyl]amino]-2-(5-methylfuran-2-yl)acetamide |
Molecular weight | 473.573 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 4.4 |
Synonyms | MLS000556111 ASN 04883130 N-cyclohexyl-2-[furan-2-ylmethyl-[2-(1H-indol-3-yl)acetyl]amino]-2-(5-methylfuran-2-yl)acetamide HMS2417L13 REGID_for_CID_3190953 [ Show all ] |
Inchi Key | AEGNAFCVMWVJIJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C28H31N3O4/c1-19-13-14-25(35-19)27(28(33)30-21-8-3-2-4-9-21)31(18-22-10-7-15-34-22)26(32)16-20-17-29-24-12-6-5-11-23(20)24/h5-7,10-15,17,21,27,29H,2-4,8-9,16,18H2,1H3,(H,30,33) |
PubChem CID | 3190953 |
ChEMBL | CHEMBL1416346 |
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 |
---|---|---|---|---|---|
3446 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
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