In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 20 | Yes |
Popular Name: (2R,4R)-1-[(2S)-2-amino-2-phenyl-propanoyl]-4-hydroxy-pyrrolidine-2-carboxylic (2R,4R)-1-[(2S)-2-amino-2-phenyl…
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) | -1.63 | 1.94 | -60.55 | 3 | 6 | -1 | 107 | 277.3 | 3 | ↓ |
Mid Mid (pH 6-8) | -1.63 | 1.76 | -88.33 | 4 | 6 | 0 | 108 | 278.308 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.