| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2008 | 41 | No |
Popular Name: 1,11,22-trihydroxy-1,6,11,16,22,27-hexazacyclodotriacontane-2,5,12,15,23,26-hexone 1,11,22-trihydroxy-1,6,11,16,22,…
| 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) | -1.15 | 2.18 | -29.91 | 6 | 15 | 0 | 209 | 586.687 | 0 | ↓ |
| Hi High (pH 8-9.5) | -1.15 | 3.08 | -68.74 | 5 | 15 | -1 | 212 | 585.679 | 0 | ↓ |
| Hi High (pH 8-9.5) | -1.15 | 3.23 | -76.02 | 5 | 15 | -1 | 212 | 585.679 | 0 | ↓ |
| Hi High (pH 8-9.5) | -1.15 | 4.13 | -130.67 | 4 | 15 | -2 | 215 | 584.671 | 0 | ↓ |
| Hi High (pH 8-9.5) | -1.15 | 3.22 | -75.25 | 5 | 15 | -1 | 212 | 585.679 | 0 | ↓ |
| Hi High (pH 8-9.5) | -1.15 | 4.12 | -126.8 | 4 | 15 | -2 | 215 | 584.671 | 0 | ↓ |
| Hi High (pH 8-9.5) | -1.15 | 4.27 | -132.49 | 4 | 15 | -2 | 215 | 584.671 | 0 | ↓ |
| Hi High (pH 8-9.5) | -1.15 | 5.17 | -199.83 | 3 | 15 | -3 | 217 | 583.663 | 0 | ↓ |
