In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2008 | 27 | Yes |
Popular Name: N-(2-diethylaminoethyl)-N-ethyl-2-[(2R)-3-oxo-1-(2-pyridylmethyl)piperazin-2-yl]acetamide N-(2-diethylaminoethyl)-N-ethyl-…
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) | 1.53 | -0.41 | -86.68 | 3 | 7 | 2 | 71 | 377.533 | 10 | ↓ |
Lo Low (pH 4.5-6) | 1.53 | -0.35 | -187.11 | 4 | 7 | 3 | 72 | 378.541 | 10 | ↓ |