In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2010 | 29 | Yes |
Popular Name: 2-(N-(4-tert-butylphenyl)sulfonyl-4-methyl-anilino)-N,N-diethyl-acetamide 2-(N-(4-tert-butylphenyl)sulfony…
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) | 5.21 | 11.22 | -12.36 | 0 | 5 | 0 | 58 | 416.587 | 8 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
OX2R-1-E | Orexin Receptor 2 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 5 | 0.40 | Binding ≤ 10μM |
OX2R-1-E | Orexin Receptor 2 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 5 | 0.40 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
OX2R_HUMAN | O43614 | Orexin Receptor 2, Human | 5 | 0.40 | Binding ≤ 1μM |
OX2R_HUMAN | O43614 | Orexin Receptor 2, Human | 5 | 0.40 | Binding ≤ 10μM |
OX2R_HUMAN | O43614 | Orexin Receptor 2, Human | 5 | 0.40 | Functional ≤ 10μM |
Description | Species |
---|---|
G alpha (q) signalling events | |
Orexin and neuropeptides FF and QRFP bind to their respective receptors |