In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 26 | Yes |
Popular Name: 4-(3-phenyl-1,2,4-thiadiazol-5-yl)-N-pyrimidin-4-yl-piperazine-1-carboxamide 4-(3-phenyl-1,2,4-thiadiazol-5-y…
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) | 2.11 | 8.74 | -13.29 | 1 | 8 | 0 | 87 | 367.438 | 3 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
FAAH1-5-E | Anandamide Amidohydrolase (cluster #5 Of 7), Eukaryotic | Eukaryotes | 6 | 0.44 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
FAAH1_RAT | P97612 | Anandamide Amidohydrolase, Rat | 6.3 | 0.44 | Binding ≤ 1μM |
FAAH1_HUMAN | O00519 | Anandamide Amidohydrolase, Human | 10.3 | 0.43 | Binding ≤ 1μM |
FAAH1_RAT | P97612 | Anandamide Amidohydrolase, Rat | 6.3 | 0.44 | Binding ≤ 10μM |
FAAH1_HUMAN | O00519 | Anandamide Amidohydrolase, Human | 10.3 | 0.43 | Binding ≤ 10μM |