In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2011 | 18 | Yes |
Popular Name: [4-[[(1S,3R)-3-ethylcyclohexoxy]methyl]phenyl]methanamine [4-[[(1S,3R)-3-ethylcyclohexoxy]…
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) | 3.67 | 7.16 | -44.15 | 3 | 2 | 1 | 37 | 248.39 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.67 | 6.76 | -3.21 | 2 | 2 | 0 | 35 | 247.382 | 5 | ↓ |