In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 16 | Yes |
Popular Name: N-methyl-1-(piperidin-2-yl)-N-(pyridin-3-ylmethyl)methanamine hydrochloride N-methyl-1-(piperidin-2-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) | 1.19 | 6.5 | -120.48 | 3 | 3 | 2 | 34 | 221.348 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.19 | 4.55 | -36.45 | 2 | 3 | 1 | 33 | 220.34 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.19 | 5.24 | -38.87 | 2 | 3 | 1 | 29 | 220.34 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.19 | 5.01 | -82.57 | 3 | 3 | 2 | 34 | 221.348 | 4 | ↓ |