In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 23 | Yes |
Popular Name: 1-ethyl-4-[1-(3-phenylpropyl)-4-piperidyl]piperazine 1-ethyl-4-[1-(3-phenylpropyl)-4-…
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) | 3.35 | 11.04 | -84.69 | 2 | 3 | 2 | 12 | 317.521 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.35 | 8.73 | -39.13 | 1 | 3 | 1 | 11 | 316.513 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.35 | 10.99 | -106 | 2 | 3 | 2 | 12 | 317.521 | 6 | ↓ |