In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 20 | Yes |
Popular Name: 1-methyl-4-[1-(4-pyridylmethyl)-4-piperidyl]piperazine 1-methyl-4-[1-(4-pyridylmethyl)-…
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) | 0.76 | 7.06 | -90.57 | 2 | 4 | 2 | 25 | 276.428 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.76 | 6.84 | -111.11 | 2 | 4 | 2 | 25 | 276.428 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.76 | 4.59 | -43.33 | 1 | 4 | 1 | 24 | 275.42 | 3 | ↓ |