In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2009 | 21 | No |
Popular Name: 4-[[[(3S)-1-ethyl-2,5-dioxo-pyrrolidin-3-yl]-methyl-amino]methyl]benzoic 4-[[[(3S)-1-ethyl-2,5-dioxo-pyrr…
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) | 0.82 | 7.93 | -86.81 | 1 | 6 | 0 | 82 | 290.319 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.82 | 5.43 | -53.95 | 0 | 6 | -1 | 81 | 289.311 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.