In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 18 | Yes |
Popular Name: 2-[4-(dimethylamino)-1-piperidyl]-1-piperazin-1-yl-ethanone 2-[4-(dimethylamino)-1-piperidyl…
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) | -0.59 | 3.43 | -87.51 | 3 | 5 | 2 | 45 | 256.394 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.59 | 2.14 | -37.5 | 2 | 5 | 1 | 40 | 255.386 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.59 | 2.98 | -101.12 | 3 | 5 | 2 | 45 | 256.394 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.59 | 5.61 | -171.2 | 4 | 5 | 3 | 46 | 257.402 | 3 | ↓ |