In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2008 | 28 | Yes |
Popular Name: (2S)-1-(cyclohexoxy)-3-[4-[(2R)-3-(cyclohexoxy)-2-hydroxy-propyl]piperazin-1-yl]propan-2-ol (2S)-1-(cyclohexoxy)-3-[4-[(2R)-…
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) | 2.72 | 2.41 | -6.46 | 2 | 6 | 0 | 65 | 398.588 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.72 | 4.8 | -41.37 | 3 | 6 | 1 | 67 | 399.596 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.72 | 4.76 | -40.79 | 3 | 6 | 1 | 67 | 399.596 | 10 | ↓ |