| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 32 | Yes |
Popular Name: [1-(4-ethylpiperazin-1-yl)-4-isoquinolyl]-(4-phenylpiperazin-1-yl)methanone [1-(4-ethylpiperazin-1-yl)-4-iso…
| 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) | 3.08 | 13.2 | -46.59 | 1 | 6 | 1 | 44 | 430.576 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.08 | 10.97 | -9.28 | 0 | 6 | 0 | 43 | 429.568 | 4 | ↓ |
