| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2011 | 21 | Yes |
Popular Name: 2-(4-isopropylpiperazin-1-yl)quinoline-3-carbonitrile 2-(4-isopropylpiperazin-1-yl)qui…
| 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) | 2.63 | 9.93 | -33.25 | 1 | 4 | 1 | 44 | 281.383 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.63 | 7.54 | -7.18 | 0 | 4 | 0 | 43 | 280.375 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
