In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | Yes |
Popular Name: [(2S,4S)-4-hydroxypyrrolidin-2-yl]-(4-prop-2-ynylpiperazin-1-yl)methanone [(2S,4S)-4-hydroxypyrrolidin-2-y…
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) | -1.03 | -0.75 | -44.7 | 3 | 5 | 1 | 60 | 238.311 | 2 | ↓ |
Lo Low (pH 4.5-6) | -1.03 | 1.51 | -101.81 | 4 | 5 | 2 | 62 | 239.319 | 2 | ↓ |