| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 19 | No |
Popular Name: 1-[3-(4-ethylpiperazin-1-yl)-3-oxo-propyl]pyrrole-2-carbaldehyde 1-[3-(4-ethylpiperazin-1-yl)-3-o…
| 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) | 0.84 | 5.12 | -10.79 | 0 | 5 | 0 | 46 | 263.341 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.84 | 7.33 | -48.62 | 1 | 5 | 1 | 47 | 264.349 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
