In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 24th, 2008 | 30 | No |
Popular Name: [1-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]indol-3-yl]-(1-naphthyl)methanone [1-[2-(4-methylmorpholin-4-ium-4…
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) | 0.67 | 15.01 | -52.86 | 0 | 4 | 1 | 31 | 399.514 | 5 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50594-1-O | Mus Musculus (cluster #1 Of 9), Other | Other | 180 | 0.31 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50594 | Z50594 | Mus Musculus | 180 | 0.31 | Functional ≤ 10μM |