In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2011 | 20 | Yes |
Popular Name: (2R)-2-(isopropylamino)-3-[4-(1-piperidyl)-1-piperidyl]propan-1-ol (2R)-2-(isopropylamino)-3-[4-(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) | 1.48 | 4.68 | -80.68 | 4 | 4 | 2 | 45 | 285.476 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.48 | 3.2 | -30.67 | 3 | 4 | 1 | 40 | 284.468 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.48 | 6.49 | -194.74 | 5 | 4 | 3 | 46 | 286.484 | 6 | ↓ |