| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 21 | No |
Popular Name: (3S)-3-[[(1S,2S,4S)-2,4-dimethylcyclohexyl]amino]-1-(1-ethylpropyl)pyrrolidine-2,5-dione (3S)-3-[[(1S,2S,4S)-2,4-dimethyl…
| 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) | 2.79 | 8.93 | -47.26 | 2 | 4 | 1 | 54 | 295.447 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 8.03 | -7.28 | 1 | 4 | 0 | 49 | 294.439 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 8.03 | -5.02 | 1 | 4 | 0 | 49 | 294.439 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
