In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 19 | Yes |
Popular Name: 2-[[[(1R,3R)-3-(trifluoromethyl)cyclohexyl]amino]methyl]phenol 2-[[[(1R,3R)-3-(trifluoromethyl)…
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) | 3.90 | 6.04 | -44.41 | 3 | 2 | 1 | 37 | 274.306 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.90 | 6.73 | -33.76 | 2 | 2 | 0 | 40 | 273.298 | 4 | ↓ |