| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 20 | No |
Popular Name: (3S)-1-(1-ethylpropyl)-3-[[(1S)-1-(3-thienyl)ethyl]amino]pyrrolidine-2,5-dione (3S)-1-(1-ethylpropyl)-3-[[(1S)-…
| 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) | 2.18 | 7.71 | -48.87 | 2 | 4 | 1 | 54 | 295.428 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 6.79 | -6.99 | 1 | 4 | 0 | 49 | 294.42 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
