In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 20 | No |
Popular Name: (3S)-1-[2-(4-formylpiperazin-1-yl)-2-oxo-ethyl]piperidine-3-carboxylic (3S)-1-[2-(4-formylpiperazin-1-y…
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) | -1.01 | 4.99 | -57.8 | 1 | 7 | 0 | 85 | 283.328 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.01 | 2.78 | -54.42 | 0 | 7 | -1 | 84 | 282.32 | 3 | ↓ |