In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2009 | 19 | No |
Popular Name: 4-[[(3S)-1-ethyl-2,5-dioxo-pyrrolidin-3-yl]-isopropyl-amino]butanoic 4-[[(3S)-1-ethyl-2,5-dioxo-pyrro…
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) | -0.03 | 6.87 | -58.8 | 1 | 6 | 0 | 82 | 270.329 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.03 | 4.76 | -48.43 | 0 | 6 | -1 | 81 | 269.321 | 7 | ↓ |