In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 22 | Yes |
Popular Name: 5-methoxy-2-[[(2R)-2-(3-pyridyl)-1-piperidyl]methyl]phenol 5-methoxy-2-[[(2R)-2-(3-pyridyl)…
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) | 2.97 | 6.65 | -35.22 | 2 | 4 | 1 | 47 | 299.394 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 7.42 | -38.39 | 1 | 4 | 0 | 50 | 298.386 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.97 | 7.08 | -99.47 | 3 | 4 | 2 | 48 | 300.402 | 4 | ↓ |