| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2010 | 20 | No |
Popular Name: (3S)-3-[[(1R)-1-(4-bromophenyl)ethyl]amino]-1-isopropyl-pyrrolidine-2,5-dione (3S)-3-[[(1R)-1-(4-bromophenyl)e…
| 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) | 2.33 | 7.28 | -53.77 | 2 | 4 | 1 | 54 | 340.241 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 6.39 | -8.27 | 1 | 4 | 0 | 49 | 339.233 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
