In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 18 | No |
Popular Name: 3-[[(1-methyl-4-piperidyl)methylamino]methyl]benzene-1,2-diol 3-[[(1-methyl-4-piperidyl)methyl…
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) | 1.54 | 3.53 | -98.33 | 5 | 4 | 2 | 61 | 252.358 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.54 | 4.44 | -74.95 | 4 | 4 | 1 | 64 | 251.35 | 4 | ↓ |