In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 20 | Yes |
Popular Name: (1R,2S)-2-(4-acetylpiperazine-1-carbonyl)cyclohexane-1-carboxylic (1R,2S)-2-(4-acetylpiperazine-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) | 0.32 | 5.58 | -65.7 | 0 | 6 | -1 | 81 | 281.332 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.32 | 4.46 | -20.01 | 1 | 6 | 0 | 78 | 282.34 | 2 | ↓ |