| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 18 | Yes |
Popular Name: (2S)-1-(4-ethylpiperazin-1-yl)-2-phenyl-propan-2-amine (2S)-1-(4-ethylpiperazin-1-yl)-2…
| 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) | 2.05 | 5.42 | -93.14 | 4 | 3 | 2 | 35 | 249.402 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 3.17 | -39.97 | 3 | 3 | 1 | 34 | 248.394 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 6.01 | -30.93 | 3 | 3 | 1 | 34 | 248.394 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 3.05 | -1.7 | 2 | 3 | 0 | 32 | 247.386 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
