| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2005 | 32 | No |
| 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) | 4.12 | 6.09 | -11.64 | 3 | 7 | 0 | 106 | 424.46 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.12 | 5.42 | -11.16 | 3 | 7 | 0 | 106 | 424.46 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.12 | 6.52 | -51.99 | 4 | 7 | 1 | 108 | 425.468 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Target | Others | Selleck Chemicals |
