In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 24 | Yes |
Popular Name: 2-[4-(2-amino-2-oxo-ethyl)piperazin-1-yl]-N-ethyl-N-[(3-fluorophenyl)methyl]acetamide 2-[4-(2-amino-2-oxo-ethyl)pipera…
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 | 2.28 | -15.52 | 2 | 6 | 0 | 70 | 336.411 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.23 | 4.5 | -41.02 | 3 | 6 | 1 | 71 | 337.419 | 7 | ↓ |