In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 25th, 2009 | 22 | Yes |
Popular Name: (2S)-1-(2-chlorophenoxy)-3-[3-(1-piperidyl)propylamino]propan-2-ol (2S)-1-(2-chlorophenoxy)-3-[3-(1…
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) | 2.62 | 7.12 | -111.83 | 4 | 4 | 2 | 51 | 328.884 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.62 | 5.72 | -38.36 | 3 | 4 | 1 | 46 | 327.876 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 4.9 | -47.2 | 3 | 4 | 1 | 49 | 327.876 | 9 | ↓ |