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Name | ethyl 4-{[(3-nitro-1H-pyrazol-1-yl)acetyl]amino}benzoate |
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Molecular formula | C14H14N4O5 |
IUPAC name | ethyl 4-[[2-(3-nitropyrazol-1-yl)acetyl]amino]benzoate |
Molecular weight | 318.289 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 1.6 |
Synonyms | AC1LO2VK MCULE-3057458753 ZINC1067728 CHEMBL1883553 SMR000296561 [ Show all ] |
Inchi Key | ABOOPRMNLKLSKC-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H14N4O5/c1-2-23-14(20)10-3-5-11(6-4-10)15-13(19)9-17-8-7-12(16-17)18(21)22/h3-8H,2,9H2,1H3,(H,15,19) |
PubChem CID | 1256540 |
ChEMBL | CHEMBL1883553 |
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 |
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463076 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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