| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 28 | Yes |
Popular Name: (2S)-2-(4-isopropoxyphenyl)-2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]acetic (2S)-2-(4-isopropoxyphenyl)-2-[4…
| 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) | 1.61 | 9.05 | -31.07 | 1 | 7 | 0 | 77 | 389.496 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 7.06 | -54.15 | 0 | 7 | -1 | 76 | 388.488 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
