In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 21 | Yes |
Popular Name: (2S)-2-[methyl-[(2R)-1-(4-piperidyl)pyrrolidine-2-carbonyl]amino]butanoic (2S)-2-[methyl-[(2R)-1-(4-piperi…
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) | -1.44 | 5.16 | -69.92 | 2 | 6 | 0 | 80 | 297.399 | 5 | ↓ |
Mid Mid (pH 6-8) | -1.44 | 7.05 | -106.89 | 3 | 6 | 1 | 81 | 298.407 | 5 | ↓ |