In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 26 | Yes |
Popular Name: N-[6-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]-3-pyridyl]-2-phenyl-acetamide N-[6-[4-[(2S)-2-hydroxypropyl]pi…
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) | 1.92 | 4.78 | -12.4 | 2 | 6 | 0 | 69 | 354.454 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 7.06 | -44.15 | 3 | 6 | 1 | 70 | 355.462 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 5.1 | -36.98 | 3 | 6 | 1 | 70 | 355.462 | 6 | ↓ |