In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2010 | 19 | Yes |
Popular Name: 2-[[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]methyl]-5-methoxy-phenol 2-[[[(1S,2R,3S)-2,3-dimethylcycl…
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) | 3.86 | 5.52 | -37.9 | 3 | 3 | 1 | 46 | 264.389 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.86 | 6.27 | -31.83 | 2 | 3 | 0 | 49 | 263.381 | 4 | ↓ |