In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 16 | Yes |
Popular Name: (2S)-2-(4-methyl-1-piperidyl)-2-(1-methylpyrazol-4-yl)ethanamine (2S)-2-(4-methyl-1-piperidyl)-2-…
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) | 0.26 | 2.47 | -51.4 | 3 | 4 | 1 | 49 | 223.344 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.26 | 4.61 | -125.77 | 4 | 4 | 2 | 50 | 224.352 | 3 | ↓ |