In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 21 | Yes |
Popular Name: 4-pyridyl-[4-(2-pyridylmethyl)piperazin-1-yl]methanone 4-pyridyl-[4-(2-pyridylmethyl)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) | -0.26 | 4.08 | -10.34 | 0 | 5 | 0 | 49 | 282.347 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.26 | 4.47 | -41.76 | 1 | 5 | 1 | 51 | 283.355 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.26 | 6.73 | -123.55 | 2 | 5 | 2 | 52 | 284.363 | 3 | ↓ |