In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 21 | Yes |
Popular Name: (2S)-1-(2-chlorophenoxy)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propan-2-ol (2S)-1-(2-chlorophenoxy)-3-[4-(2…
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) | 1.27 | -0.75 | -10.08 | 2 | 5 | 0 | 56 | 314.813 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.27 | 1.6 | -45.97 | 3 | 5 | 1 | 57 | 315.821 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.27 | 1.65 | -39.08 | 3 | 5 | 1 | 57 | 315.821 | 7 | ↓ |