In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 18 | Yes |
Popular Name: N-[[(2R)-1-(2-pyridylmethyl)-2-piperidyl]methyl]propan-1-amine N-[[(2R)-1-(2-pyridylmethyl)-2-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) | 1.78 | 6.61 | -41.77 | 2 | 3 | 1 | 33 | 248.394 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 8.59 | -116.84 | 3 | 3 | 2 | 34 | 249.402 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 6.66 | -96.12 | 3 | 3 | 2 | 34 | 249.402 | 6 | ↓ |