In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2004 | 18 | Yes |
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) | 3.17 | -1.22 | -6.6 | 1 | 2 | 0 | 29 | 240.302 | 2 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50622-1-O | Human Rhinovirus 1B (cluster #1 Of 2), Other | Other | 3590 | 0.42 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50622 | Z50622 | Human Rhinovirus 1B | 3590 | 0.42 | Functional ≤ 10μM |