In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 19 | Yes |
Popular Name: (2R)-2-[[[(2S)-2-cyanopropyl]-methyl-carbamoyl]amino]pentanedioic (2R)-2-[[[(2S)-2-cyanopropyl]-me…
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) | -1.36 | 5.91 | -110.79 | 1 | 8 | -2 | 136 | 269.257 | 7 | ↓ |
Lo Low (pH 4.5-6) | -1.36 | 4 | -58.02 | 2 | 8 | -1 | 134 | 270.265 | 7 | ↓ |