| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 22 | Yes |
Popular Name: 5-[3-(4-methylpiperazin-1-yl)propyl]-2-pyrrolidin-1-yl-aniline 5-[3-(4-methylpiperazin-1-yl)pro…
| 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) | 2.47 | 7.74 | -36.07 | 3 | 4 | 1 | 37 | 303.474 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.47 | 5.49 | -3.68 | 2 | 4 | 0 | 36 | 302.466 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.47 | 7.64 | -92.32 | 4 | 4 | 2 | 39 | 304.482 | 5 | ↓ |
