| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 23 | Yes |
Popular Name: 5-[4-[(4-methylpiperazin-1-yl)methyl]anilino]-5-oxo-pentanoic 5-[4-[(4-methylpiperazin-1-yl)me…
| 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) | 1.10 | 6.17 | -85.17 | 2 | 6 | 0 | 77 | 319.405 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.10 | 3.7 | -58.8 | 1 | 6 | -1 | 76 | 318.397 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.10 | 6.04 | -80.65 | 2 | 6 | 0 | 77 | 319.405 | 7 | ↓ |
