In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: [6-methyl-2-[(1S,3R)-3-methylcyclohexoxy]-3-pyridyl]methanamine [6-methyl-2-[(1S,3R)-3-methylcyc…
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) | 2.20 | 4.29 | -42.2 | 3 | 3 | 1 | 50 | 235.351 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.20 | 3.88 | -4.33 | 2 | 3 | 0 | 48 | 234.343 | 3 | ↓ |