| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 18 | Yes |
Popular Name: 3-[4-[(1R)-1-methylpropyl]piperazin-1-yl]pyrazine-2-carbonitrile 3-[4-[(1R)-1-methylpropyl]pipera…
| 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) | 1.55 | 6.4 | -36.56 | 1 | 5 | 1 | 57 | 246.338 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.55 | 4.54 | -7.55 | 0 | 5 | 0 | 56 | 245.33 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
