In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 9th, 2008 | 22 | Yes |
Popular Name: (3R,5S)-3,5-dimethyl-1-[1-(o-tolylmethyl)-4-piperidyl]piperidine (3R,5S)-3,5-dimethyl-1-[1-(o-tol…
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) | 4.19 | 11.12 | -34.56 | 1 | 2 | 1 | 8 | 301.498 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.19 | 13.02 | -106.05 | 2 | 2 | 2 | 9 | 302.506 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.19 | 10.78 | -35.88 | 1 | 2 | 1 | 8 | 301.498 | 3 | ↓ |