In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 23 | Yes |
Popular Name: 2-(4-{[2-(1-piperidinyl)-3-pyridinyl]carbonyl}-1-piperazinyl)ethanol 2-(4-{[2-(1-piperidinyl)-3-pyrid…
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) | 0.23 | 2.57 | -12.48 | 1 | 6 | 0 | 60 | 318.421 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.23 | 4.92 | -44.18 | 2 | 6 | 1 | 61 | 319.429 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.23 | 5.33 | -91.14 | 3 | 6 | 2 | 62 | 320.437 | 4 | ↓ |