In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2010 | 16 | Yes |
Popular Name: N-methyl-1-[2-[(2R)-2-methyl-1-piperidyl]-3-pyridyl]methanamine N-methyl-1-[2-[(2R)-2-methyl-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) | 1.89 | 6.43 | -41.61 | 2 | 3 | 1 | 33 | 220.34 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.89 | 4.97 | -3.91 | 1 | 3 | 0 | 28 | 219.332 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 6.89 | -92.94 | 3 | 3 | 2 | 34 | 221.348 | 3 | ↓ |