In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2008 | 33 | Yes |
Popular Name: 2-[4-(dimethyl-oxo-BLAHyl)piperazin-1-yl]-N-isopropyl-acetamide 2-[4-(dimethyl-oxo-BLAHyl)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) | 3.72 | 8.74 | -28.11 | 1 | 8 | 0 | 83 | 464.595 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.72 | 9.1 | -41.84 | 2 | 8 | 1 | 84 | 465.603 | 4 | ↓ |