In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2006 | 16 | No |
Popular Name: BE-6143 BE-6143
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) | 1.27 | -5.69 | -28.55 | 3 | 4 | 1 | 41 | 237.714 | 2 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
NISCH-1-E | Nischarin (cluster #1 Of 4), Eukaryotic | Eukaryotes | 232 | 0.58 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
NISCH_HUMAN | Q9Y2I1 | Nischarin, Human | 231.739465 | 0.58 | Binding ≤ 1μM |
NISCH_HUMAN | Q9Y2I1 | Nischarin, Human | 231.739465 | 0.58 | Binding ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.