| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 1st, 2009 | 30 | Yes |
Popular Name: N-[(4-chlorophenyl)methyl]-1-methyl-6-(morpholinomethyl)-4-oxo-quinoline-3-carboxamide N-[(4-chlorophenyl)methyl]-1-met…
| 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) | 1.76 | 8.8 | -30.6 | 1 | 6 | 0 | 64 | 425.916 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DPOL-4-V | Human Herpesvirus 6 DNA Polymerase (cluster #4 Of 4), Viral | Viruses | 370 | 0.30 | Binding ≤ 10μM |
| Z50530-1-O | Human Herpesvirus 5 (cluster #1 Of 5), Other | Other | 300 | 0.30 | Functional ≤ 10μM |
| Z80583-1-O | Vero (Kidney Cells) (cluster #1 Of 7), Other | Other | 3500 | 0.25 | Functional ≤ 10μM |
| Z80954-1-O | HFF (Foreskin Fibroblasts) (cluster #1 Of 4), Other | Other | 900 | 0.28 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DPOL_VZVD | P09252 | DNA Polymerase, Vzvd | 370 | 0.30 | Binding ≤ 1μM |
| DPOL_HHV11 | P04293 | Human Herpesvirus 1 DNA Polymerase, Hhv11 | 600 | 0.29 | Binding ≤ 1μM |
| DPOL_HCMVA | P08546 | Human Herpesvirus 5 DNA Polymerase, Hcmva | 700 | 0.29 | Binding ≤ 1μM |
| DPOL_VZVD | P09252 | DNA Polymerase, Vzvd | 370 | 0.30 | Binding ≤ 10μM |
| DPOL_HHV11 | P04293 | Human Herpesvirus 1 DNA Polymerase, Hhv11 | 600 | 0.29 | Binding ≤ 10μM |
| DPOL_HCMVA | P08546 | Human Herpesvirus 5 DNA Polymerase, Hcmva | 700 | 0.29 | Binding ≤ 10μM |
| Z80954 | Z80954 | HFF (Foreskin Fibroblasts) | 340 | 0.30 | Functional ≤ 10μM |
| Z50530 | Z50530 | Human Herpesvirus 5 | 300 | 0.30 | Functional ≤ 10μM |
| Z80583 | Z80583 | Vero (Kidney Cells) | 3500 | 0.25 | Functional ≤ 10μM |
