In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 21 | No |
Popular Name: 3,3-diethyl-1-[3-[(1S)-1-(methylamino)ethyl]phenyl]pyrrolidine-2,5-dione 3,3-diethyl-1-[3-[(1S)-1-(methyl…
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) | 2.27 | 7.7 | -44.76 | 2 | 4 | 1 | 54 | 289.399 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 6.52 | -9.6 | 1 | 4 | 0 | 49 | 288.391 | 5 | ↓ |