In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2010 | 18 | Yes |
Popular Name: 2-[[[(1R)-2-cyclohexyl-1-methyl-ethyl]amino]methyl]phenol 2-[[[(1R)-2-cyclohexyl-1-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) | 4.51 | 6.97 | -36.17 | 3 | 2 | 1 | 37 | 248.39 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.51 | 7.72 | -31.76 | 2 | 2 | 0 | 40 | 247.382 | 5 | ↓ |