| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2010 | 21 | Yes |
Popular Name: 2-butoxy-N-[2-(4-cyclopentylpiperazin-1-yl)ethyl]ethanamine 2-butoxy-N-[2-(4-cyclopentylpipe…
| 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) | 2.49 | 7.23 | -87.94 | 3 | 4 | 2 | 34 | 299.503 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.49 | 3.67 | -1.74 | 1 | 4 | 0 | 28 | 297.487 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.49 | 5.87 | -31.15 | 2 | 4 | 1 | 29 | 298.495 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.49 | 5.03 | -36.82 | 2 | 4 | 1 | 32 | 298.495 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
