In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (2S)-2-isopropyl-2-methyl-4-oxo-4-[(2R)-2-(2-thienyl)pyrrolidin-1-yl]butanoic (2S)-2-isopropyl-2-methyl-4-oxo-…
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) | 2.80 | 9.81 | -62.43 | 0 | 4 | -1 | 60 | 308.423 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.80 | 7.98 | -13.06 | 1 | 4 | 0 | 58 | 309.431 | 5 | ↓ |