| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 19 | Yes |
Popular Name: 2-[4-[(3S)-3-amino-3-phenyl-propyl]piperazin-1-yl]ethanol 2-[4-[(3S)-3-amino-3-phenyl-prop…
| 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) | -1.01 | -0.12 | -47.16 | 4 | 4 | 1 | 54 | 264.393 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.01 | -0.46 | -5.18 | 3 | 4 | 0 | 53 | 263.385 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.01 | 1.83 | -35.33 | 4 | 4 | 1 | 54 | 264.393 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -1.01 | 2.13 | -121.47 | 5 | 4 | 2 | 56 | 265.401 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
