In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 16 | Yes |
Popular Name: N-methyl-1-(piperidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine hydrochloride N-methyl-1-(piperidin-3-yl)-N-(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) | 0.78 | 6.12 | -100.6 | 3 | 3 | 2 | 34 | 221.348 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.78 | 4.82 | -34.63 | 2 | 3 | 1 | 29 | 220.34 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.78 | 4.15 | -35.33 | 2 | 3 | 1 | 33 | 220.34 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.78 | 4.88 | -81.39 | 3 | 3 | 2 | 34 | 221.348 | 4 | ↓ |