In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: [6-methyl-2-[4-(1-piperidyl)-1-piperidyl]-3-pyridyl]methanamine [6-methyl-2-[4-(1-piperidyl)-1-p…
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) | 1.66 | 8.31 | -175.17 | 5 | 4 | 3 | 49 | 291.463 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.66 | 7.89 | -79.9 | 4 | 4 | 2 | 48 | 290.455 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.66 | 7.55 | -32.02 | 3 | 4 | 1 | 47 | 289.447 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.66 | 7.87 | -97.34 | 4 | 4 | 2 | 48 | 290.455 | 3 | ↓ |