| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2010 | 17 | No |
Popular Name: (3R)-3-[[(1S)-1-(3-fluorophenyl)ethyl]amino]pyrrolidine-2,5-dione (3R)-3-[[(1S)-1-(3-fluorophenyl)…
| 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) | 0.74 | 1.96 | -9.9 | 2 | 4 | 0 | 58 | 236.246 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.93 | -0.58 | -40.21 | 1 | 4 | -1 | 65 | 235.238 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.93 | 0.41 | -46.11 | 2 | 4 | 0 | 69 | 236.246 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
