| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 19 | No |
Popular Name: (3S)-1-isopropyl-3-[2-(1-piperidyl)ethylamino]pyrrolidine-2,5-dione (3S)-1-isopropyl-3-[2-(1-piperid…
| 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) | 0.50 | 6.29 | -127.32 | 3 | 5 | 2 | 58 | 269.389 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.50 | 2.8 | -8.76 | 1 | 5 | 0 | 53 | 267.373 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.50 | 5.03 | -41.56 | 2 | 5 | 1 | 54 | 268.381 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
