| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 18 | Yes |
Popular Name: (3R,6S)-6-ethyl-3-methyl-1-[[(2S)-tetrahydropyran-2-yl]methyl]-1,5-diazocane (3R,6S)-6-ethyl-3-methyl-1-[[(2S…
| 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) | 2.75 | 6.7 | -30.78 | 2 | 3 | 1 | 26 | 255.426 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.75 | 6.01 | -31.66 | 2 | 3 | 1 | 29 | 255.426 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.75 | 7.49 | -100.32 | 3 | 3 | 2 | 30 | 256.434 | 3 | ↓ |
