In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2005 | 29 | Yes |
Popular Name: AM-404 AM-404
Find On: PubMed — Wikipedia — Google
CAS Numbers: 183718-77-6 , 183718-77-6; 198022-70-7 , 198022-70-7
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 7.50 | 13.41 | -10.21 | 2 | 3 | 0 | 49 | 395.587 | 15 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_SUBSTANCE_COMMENT | NCC_SAMPLE_SUPPLIER : Tocris Cookson Ltd.; NCC_SUPPLIER_STRUCTURE_ID : 100122 | NIH Clinical Collection via PubChem |
PUBCHEM_SUBSTANCE_COMMENT | SAMPLE_SUPPLIER: Tocris Bioscience; SUPPLIER_STRUCTURE_ID: 100122 | NIH Clinical Collection via PubChem |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
CNR1-5-E | Cannabinoid CB1 Receptor (cluster #5 Of 5), Eukaryotic | Eukaryotes | 1760 | 0.28 | Binding ≤ 10μM |
CNR2-2-E | Cannabinoid CB2 Receptor (cluster #2 Of 3), Eukaryotic | Eukaryotes | 1300 | 0.28 | Binding ≤ 10μM |
FAAH1-1-E | Anandamide Amidohydrolase (cluster #1 Of 7), Eukaryotic | Eukaryotes | 3700 | 0.26 | Binding ≤ 10μM |
Z50587-4-O | Homo Sapiens (cluster #4 Of 9), Other | Other | 4000 | 0.26 | Functional ≤ 10μM |
Z50594-7-O | Mus Musculus (cluster #7 Of 9), Other | Other | 10000 | 0.24 | Functional ≤ 10μM |
Z80566-2-O | U-937 (Histiocytic Lymphoma Cells) (cluster #2 Of 2), Other | Other | 4000 | 0.26 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
FAAH1_RAT | P97612 | Anandamide Amidohydrolase, Rat | 3700 | 0.26 | Binding ≤ 10μM |
CNR1_HUMAN | P21554 | Cannabinoid CB1 Receptor, Human | 1500 | 0.28 | Binding ≤ 10μM |
CNR1_RAT | P20272 | Cannabinoid CB1 Receptor, Rat | 1760 | 0.28 | Binding ≤ 10μM |
CNR2_HUMAN | P34972 | Cannabinoid CB2 Receptor, Human | 1300 | 0.28 | Binding ≤ 10μM |
Z50587 | Z50587 | Homo Sapiens | 4000 | 0.26 | Functional ≤ 10μM |
Z50594 | Z50594 | Mus Musculus | 10000 | 0.24 | Functional ≤ 10μM |
Z80566 | Z80566 | U-937 (Histiocytic Lymphoma Cells) | 4000 | 0.26 | Functional ≤ 10μM |
Description | Species |
---|---|
Class A/1 (Rhodopsin-like receptors) | |
G alpha (i) signalling events |