| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 21 | Yes |
Popular Name: 2-[4-[(2S,3R)-2-methyl-3-(methylamino)-3-phenyl-propyl]piperazin-1-yl]ethanol 2-[4-[(2S,3R)-2-methyl-3-(methyl…
| 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) | 1.72 | 2.49 | -41.05 | 3 | 4 | 1 | 43 | 292.447 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.72 | 3.72 | -38.19 | 3 | 4 | 1 | 40 | 292.447 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.72 | 4.45 | -113.36 | 4 | 4 | 2 | 45 | 293.455 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
