In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: [6-methyl-2-[(1R,5S)-3,3,5-trimethylcyclohexoxy]-3-pyridyl]methanamine [6-methyl-2-[(1R,5S)-3,3,5-trime…
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) | 2.85 | 5.51 | -43.65 | 3 | 3 | 1 | 50 | 263.405 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.85 | 5.08 | -4.11 | 2 | 3 | 0 | 48 | 262.397 | 3 | ↓ |