In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: N-ethyl-2-piperazin-1-yl-N-(4-pyridylmethyl)acetamide N-ethyl-2-piperazin-1-yl-N-(4-py…
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) | -0.52 | 3.56 | -42.79 | 2 | 5 | 1 | 53 | 263.365 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.52 | 2.2 | -9.59 | 1 | 5 | 0 | 48 | 262.357 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.52 | 4.02 | -83.69 | 3 | 5 | 2 | 54 | 264.373 | 5 | ↓ |