In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 20 | Yes |
Popular Name: 1-[[[1-[(2S)-2-hydroxypropyl]-4-piperidyl]methylamino]methyl]cyclohexanol 1-[[[1-[(2S)-2-hydroxypropyl]-4-…
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) | 1.62 | 4.12 | -96.88 | 5 | 4 | 2 | 61 | 286.46 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.62 | 3.09 | -35.36 | 4 | 4 | 1 | 57 | 285.452 | 6 | ↓ |