In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 20 | Yes |
Popular Name: [(2S)-pyrrolidin-2-yl]-[4-[(2S)-tetrahydrofuran-2-carbonyl]piperazin-1-yl]methanone [(2S)-pyrrolidin-2-yl]-[4-[(2S)-…
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) | -0.57 | 3.97 | -55.34 | 2 | 6 | 1 | 66 | 282.364 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.57 | 2.68 | -20.68 | 1 | 6 | 0 | 62 | 281.356 | 2 | ↓ |