In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 18 | Yes |
Popular Name: (3S)-1-[(2,5-dimethylphenyl)methyl]-5-oxo-pyrrolidine-3-carboxylic (3S)-1-[(2,5-dimethylphenyl)meth…
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) | 1.64 | 8.46 | -52.18 | 0 | 4 | -1 | 60 | 246.286 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.64 | 6.35 | -14.13 | 1 | 4 | 0 | 58 | 247.294 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.