In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 18 | Yes |
Popular Name: (3S)-3-(methylamino)-1-[2-(3-methylphenoxy)ethyl]pyrrolidin-2-one (3S)-3-(methylamino)-1-[2-(3-met…
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) | 1.67 | 5.62 | -43.39 | 2 | 4 | 1 | 46 | 249.334 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.67 | 4.33 | -7.67 | 1 | 4 | 0 | 42 | 248.326 | 5 | ↓ |