In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2010 | 21 | Yes |
Popular Name: N-[2-(diisopropylamino)ethyl]-1-prop-2-ynyl-piperidine-4-carboxamide N-[2-(diisopropylamino)ethyl]-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) | 1.76 | 5.86 | -40.21 | 2 | 4 | 1 | 37 | 294.463 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.94 | 0.87 | -6.85 | 1 | 4 | 0 | 39 | 293.455 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.94 | 5.41 | -79 | 3 | 4 | 2 | 41 | 295.471 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 8.14 | -88.3 | 3 | 4 | 2 | 38 | 295.471 | 7 | ↓ |