In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: 2-(dimethylamino)-1-[4-[(2R,4R)-4-hydroxypyrrolidine-2-carbonyl]piperazin-1-yl]ethanone 2-(dimethylamino)-1-[4-[(2R,4R)-…
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) | -1.83 | 0.82 | -90.01 | 4 | 7 | 2 | 82 | 286.376 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.83 | -1.57 | -47.52 | 3 | 7 | 1 | 81 | 285.368 | 3 | ↓ |