In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2009 | 20 | Yes |
Popular Name: 1-methyl-4-[2-(2,4,5-trimethylphenoxy)ethyl]piperidin-4-amine 1-methyl-4-[2-(2,4,5-trimethylph…
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) | 3.37 | 5.65 | -47.18 | 3 | 3 | 1 | 40 | 277.432 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.37 | 7.81 | -39.2 | 3 | 3 | 1 | 40 | 277.432 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.37 | 8.07 | -118.17 | 4 | 3 | 2 | 41 | 278.44 | 4 | ↓ |