In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 17 | Yes |
Popular Name: [(1R,3R)-3-methyl-1-(4-pyridylmethylamino)cyclohexyl]methanol [(1R,3R)-3-methyl-1-(4-pyridylme…
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) | 1.56 | 3.9 | -37.5 | 3 | 3 | 1 | 50 | 235.351 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.56 | 3.09 | -4.12 | 2 | 3 | 0 | 45 | 234.343 | 4 | ↓ |