In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 9th, 2008 | 22 | Yes |
Popular Name: (3R,5S)-3,5-dimethyl-1-[1-(m-tolylmethyl)-4-piperidyl]piperidine (3R,5S)-3,5-dimethyl-1-[1-(m-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) | 4.21 | 10.63 | -33.94 | 1 | 2 | 1 | 8 | 301.498 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.21 | 12.94 | -105.84 | 2 | 2 | 2 | 9 | 302.506 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.21 | 10.7 | -36.65 | 1 | 2 | 1 | 8 | 301.498 | 3 | ↓ |