| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 20 | Yes |
Popular Name: (1S,6S)-6-(4-isopropylpiperazine-1-carbonyl)cyclohex-3-ene-1-carboxylic (1S,6S)-6-(4-isopropylpiperazine…
| 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) | 1.14 | 6.78 | -56.2 | 0 | 5 | -1 | 64 | 279.36 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 8.92 | -62.93 | 1 | 5 | 0 | 65 | 280.368 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.14 | 6.76 | -40.39 | 2 | 5 | 1 | 62 | 281.376 | 3 | ↓ |
