| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 24 | No |
Popular Name: 2-butyl-5-(4-methylpiperazine-1-carbonyl)isoindoline-1,3-dione 2-butyl-5-(4-methylpiperazine-1-…
| 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) | 1.80 | 8.02 | -47.74 | 1 | 6 | 1 | 64 | 330.408 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 5.67 | -12.01 | 0 | 6 | 0 | 63 | 329.4 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
