| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 19 | Yes |
Popular Name: (2S)-2-(4-cyclopentylpiperazin-1-yl)-N-(2-methoxyethyl)propan-1-amine (2S)-2-(4-cyclopentylpiperazin-1…
| 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) | 1.38 | 5.58 | -90.66 | 3 | 4 | 2 | 34 | 271.449 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.38 | 2.04 | -2.2 | 1 | 4 | 0 | 28 | 269.433 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.38 | 4.22 | -32.95 | 2 | 4 | 1 | 29 | 270.441 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.38 | 3.42 | -34.61 | 2 | 4 | 1 | 32 | 270.441 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
