In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 19 | Yes |
Popular Name: 2-[[3-[(2S)-2-methyl-1-piperidyl]propylamino]methyl]phenol 2-[[3-[(2S)-2-methyl-1-piperidyl…
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) | 2.98 | 5.5 | -32.58 | 3 | 3 | 1 | 37 | 263.405 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.98 | 5.39 | -34.08 | 2 | 3 | 0 | 43 | 262.397 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 4.6 | -39.32 | 3 | 3 | 1 | 40 | 263.405 | 6 | ↓ |