In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 20 | Yes |
Popular Name: (3R,6R)-6-ethyl-3-methyl-1-[(1R,2R)-2-phenylcyclopropyl]-1,5-diazocane (3R,6R)-6-ethyl-3-methyl-1-[(1R,…
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) | 3.57 | 8.7 | -31.94 | 2 | 2 | 1 | 20 | 273.444 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.57 | 9.79 | -96.86 | 3 | 2 | 2 | 21 | 274.452 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.57 | 8.49 | -28.62 | 2 | 2 | 1 | 16 | 273.444 | 3 | ↓ |