| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2010 | 18 | Yes |
Popular Name: (3R,6S)-6-ethyl-3-methyl-1-[2-[(2S)-tetrahydrofuran-2-yl]ethyl]-1,5-diazocane (3R,6S)-6-ethyl-3-methyl-1-[2-[(…
| 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) | 2.15 | 7.4 | -102.21 | 3 | 3 | 2 | 30 | 256.434 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.15 | 6.02 | -33.25 | 2 | 3 | 1 | 29 | 255.426 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.15 | 6.61 | -31.24 | 2 | 3 | 1 | 26 | 255.426 | 4 | ↓ |
