| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 23 | Yes |
Popular Name: 4-[4-(4-isopropylpiperazin-1-yl)anilino]-4-oxo-butanoic 4-[4-(4-isopropylpiperazin-1-yl)…
| 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) | 1.57 | 6.11 | -75.52 | 2 | 6 | 0 | 77 | 319.405 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.57 | 3.84 | -50.11 | 1 | 6 | -1 | 76 | 318.397 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.57 | 4.99 | -44.96 | 3 | 6 | 1 | 74 | 320.413 | 6 | ↓ |
