In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 18th, 2008 | 25 | No |
Popular Name: (3S)-3-[[(1S,2S,3R)-2,3-dimethylcyclohexyl]amino]-1-(4-ethoxyphenyl)pyrrolidine-2,5-dione (3S)-3-[[(1S,2S,3R)-2,3-dimethyl…
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) | 2.94 | 8.79 | -55.07 | 2 | 5 | 1 | 63 | 345.463 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.94 | 7.83 | -12.74 | 1 | 5 | 0 | 59 | 344.455 | 5 | ↓ |