In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 16 | Yes |
Popular Name: (4R)-4-ethyl-1-[(2R)-3-methoxy-2-methyl-propyl]-1,5-diazocane (4R)-4-ethyl-1-[(2R)-3-methoxy-2…
None
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) | 2.13 | 6.39 | -106.23 | 3 | 3 | 2 | 30 | 230.396 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.13 | 5.42 | -30.65 | 2 | 3 | 1 | 26 | 229.388 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.13 | 5.14 | -32.18 | 2 | 3 | 1 | 29 | 229.388 | 5 | ↓ |