| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 24th, 2010 | 15 | Yes |
Popular Name: (3S)-1-[(1S)-1,3-dimethylbutyl]-3-methyl-1,5-diazocane (3S)-1-[(1S)-1,3-dimethylbutyl]-…
| 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) | 2.64 | 5.75 | -34.76 | 2 | 2 | 1 | 20 | 213.389 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 6.82 | -26.77 | 2 | 2 | 1 | 16 | 213.389 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.64 | 7.38 | -102.65 | 3 | 2 | 2 | 21 | 214.397 | 3 | ↓ |
