| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 18 | Yes |
Popular Name: (4S,6R)-4,6-dimethyl-1-(1,1,3,3-tetramethylbutyl)-1,5-diazocane (4S,6R)-4,6-dimethyl-1-(1,1,3,3-…
| 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) | 3.97 | 6.65 | -29.68 | 2 | 2 | 1 | 20 | 255.47 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.97 | 7.2 | -26.49 | 2 | 2 | 1 | 16 | 255.47 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.97 | 8.11 | -101.4 | 3 | 2 | 2 | 21 | 256.478 | 3 | ↓ |
