In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 21 | Yes |
Popular Name: 1-(4-amino-1-piperidyl)-4-[methyl-(1-methyl-4-piperidyl)amino]butan-1-one 1-(4-amino-1-piperidyl)-4-[methy…
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) | -0.08 | 4.27 | -96.51 | 4 | 5 | 2 | 56 | 298.475 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.08 | 4.2 | -99.26 | 4 | 5 | 2 | 56 | 298.475 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.08 | 6.61 | -171.5 | 5 | 5 | 3 | 57 | 299.483 | 5 | ↓ |