In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 23 | Yes |
Popular Name: 1-(4-acetylpiperazin-1-yl)-2-[(2R)-2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]ethanone 1-(4-acetylpiperazin-1-yl)-2-[(2…
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) | -0.69 | 5.81 | -41.22 | 1 | 7 | 1 | 63 | 320.417 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.69 | 3.67 | -14.03 | 0 | 7 | 0 | 62 | 319.409 | 3 | ↓ |