| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 18 | Yes |
Popular Name: 2-[[(1S)-cyclohex-3-en-1-yl]methylamino]-1-(4-methylpiperazin-1-yl)ethanone 2-[[(1S)-cyclohex-3-en-1-yl]meth…
| 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) | 0.79 | 4.65 | -45.89 | 2 | 4 | 1 | 40 | 252.382 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.79 | 3.29 | -7.51 | 1 | 4 | 0 | 36 | 251.374 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.79 | 7 | -103.35 | 3 | 4 | 2 | 41 | 253.39 | 4 | ↓ |
