In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 30 | Yes |
Popular Name: 3-[4-[4-(1-benzyl-4-piperidyl)piperazin-1-yl]-1-piperidyl]propanoic 3-[4-[4-(1-benzyl-4-piperidyl)pi…
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) | 1.99 | 9.41 | -116.51 | 2 | 6 | 1 | 55 | 415.602 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.99 | 9.48 | -88.46 | 2 | 6 | 1 | 55 | 415.602 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.99 | 10.68 | -87.26 | 2 | 6 | 1 | 55 | 415.602 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.99 | 11.76 | -166.4 | 3 | 6 | 2 | 57 | 416.61 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.99 | 12.92 | -161.49 | 3 | 6 | 2 | 57 | 416.61 | 7 | ↓ |