| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 15 | No |
Popular Name: (3R)-3-[[(1S)-1-(3-thienyl)ethyl]amino]pyrrolidine-2,5-dione (3R)-3-[[(1S)-1-(3-thienyl)ethyl…
| 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) | 0.19 | 1.75 | -50.61 | 3 | 4 | 1 | 63 | 225.293 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.19 | 0.75 | -8.3 | 2 | 4 | 0 | 58 | 224.285 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.19 | 0.74 | -9.27 | 2 | 4 | 0 | 58 | 224.285 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.38 | -0.74 | -42.61 | 2 | 4 | 0 | 69 | 224.285 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.38 | -0.77 | -41.15 | 2 | 4 | 0 | 69 | 224.285 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
