In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 2,2-diethyl-4-oxo-4-[(2R)-2-(2-thienyl)pyrrolidin-1-yl]butanoic 2,2-diethyl-4-oxo-4-[(2R)-2-(2-t…
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) | 2.89 | 10.02 | -61.09 | 0 | 4 | -1 | 60 | 308.423 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.89 | 7.5 | -7.66 | 1 | 4 | 0 | 58 | 309.431 | 6 | ↓ |