In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 18 | Yes |
Popular Name: (3S)-3-methyl-1-[(1R,2R)-2-phenylcyclopropyl]-1,5-diazocane (3S)-3-methyl-1-[(1R,2R)-2-pheny…
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) | 2.36 | 8.39 | -33.46 | 2 | 2 | 1 | 20 | 245.39 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 8.9 | -97.12 | 3 | 2 | 2 | 21 | 246.398 | 2 | ↓ |