In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 17 | Yes |
Popular Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-[(1S)-1-methylpropyl]acetamide 2-[4-(2-hydroxyethyl)piperazin-1…
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) | 0.42 | 0.57 | -37.65 | 3 | 5 | 1 | 57 | 244.359 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.42 | 0.75 | -34.51 | 3 | 5 | 1 | 57 | 244.359 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.42 | -1.6 | -9.62 | 2 | 5 | 0 | 56 | 243.351 | 6 | ↓ |