In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 26 | Yes |
Popular Name: 1,3-benzodioxol-5-ylBLAHone 1,3-benzodioxol-5-ylBLAHone
None
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) | 4.19 | 7.98 | -18.16 | 0 | 6 | 0 | 63 | 348.31 | 1 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50606-2-O | Hepatitis B Virus (cluster #2 Of 3), Other | Other | 2180 | 0.30 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50606 | Z50606 | Hepatitis B Virus | 2180 | 0.30 | Functional ≤ 10μM |