| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 17 | Yes |
Popular Name: (3S)-3-methyl-1-(1,1,3,3-tetramethylbutyl)-1,5-diazocane (3S)-3-methyl-1-(1,1,3,3-tetrame…
| 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) | 3.44 | 8.1 | -36.38 | 2 | 2 | 1 | 20 | 241.443 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 7.4 | -23.71 | 2 | 2 | 1 | 16 | 241.443 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.44 | 7.92 | -100.78 | 3 | 2 | 2 | 21 | 242.451 | 3 | ↓ |
