| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 34 | No |
Popular Name: 12-[[6-(4-ethylpiperazin-1-yl)pyridine-3-carbonyl]amino]dodecyl 12-[[6-(4-ethylpiperazin-1-yl)py…
| 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) | 4.55 | 11.31 | -55.15 | 2 | 8 | 1 | 93 | 497.726 | 17 | ↓ |
| Mid Mid (pH 6-8) | 4.55 | 9.09 | -19.08 | 1 | 8 | 0 | 92 | 496.718 | 17 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
