| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2010 | 38 | No |
Popular Name: N-[(4-chlorophenyl)methyl]-bis(morpholinomethyl)-oxo-BLAHcarboxamide N-[(4-chlorophenyl)methyl]-bis(m…
| 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) | 1.95 | 7.7 | -12.92 | 1 | 8 | 0 | 76 | 535.044 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.95 | 9.97 | -56.6 | 2 | 8 | 1 | 77 | 536.052 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.95 | 12.26 | -109.13 | 3 | 8 | 2 | 78 | 537.06 | 7 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50530-1-O | Human Herpesvirus 5 (cluster #1 Of 5), Other | Other | 30 | 0.28 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50530 | Z50530 | Human Herpesvirus 5 | 30 | 0.28 | Functional ≤ 10μM |
