In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 23 | Yes |
Popular Name: 3-[4-[4-(4-piperidyl)piperazin-1-yl]-1-piperidyl]propanoic 3-[4-[4-(4-piperidyl)piperazin-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) | 0.00 | 3.87 | -114.05 | 3 | 6 | 1 | 68 | 325.477 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.00 | 3.99 | -90.14 | 3 | 6 | 1 | 68 | 325.477 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.00 | 7.13 | -156.88 | 4 | 6 | 2 | 69 | 326.485 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.00 | 6.21 | -162.67 | 4 | 6 | 2 | 69 | 326.485 | 5 | ↓ |