In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2009 | 19 | Yes |
Popular Name: 4-[2-(2-chloro-5-methyl-phenoxy)ethyl]-1-methyl-piperidin-4-amine 4-[2-(2-chloro-5-methyl-phenoxy)…
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) | 3.22 | 4.78 | -49.24 | 3 | 3 | 1 | 40 | 283.823 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 6.94 | -40.46 | 3 | 3 | 1 | 40 | 283.823 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.22 | 7.2 | -120.17 | 4 | 3 | 2 | 41 | 284.831 | 4 | ↓ |