In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2006 | 22 | 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) | 3.66 | 9.89 | -45.84 | 1 | 4 | 1 | 35 | 291.378 | 3 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50651-1-O | Vesicular Stomatitis Virus (cluster #1 Of 2), Other | Other | 9550 | 0.32 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50651 | Z50651 | Vesicular Stomatitis Virus | 1445.43977 | 0.37 | Functional ≤ 10μM |