In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 18th, 2008 | 21 | Yes |
Popular Name: (2R)-1-(4-methylpiperazin-1-yl)-3-[(1S,5S)-3,3,5-trimethylcyclohexoxy]propan-2-ol (2R)-1-(4-methylpiperazin-1-yl)-…
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) | 2.14 | 5.26 | -37.74 | 2 | 4 | 1 | 37 | 299.479 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.14 | 2.79 | -4.01 | 1 | 4 | 0 | 36 | 298.471 | 5 | ↓ |