In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: (1S,2R)-2-[4-[2-(dimethylamino)acetyl]piperazine-1-carbonyl]cyclopropanecarboxylic (1S,2R)-2-[4-[2-(dimethylamino)a…
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) | -0.74 | 6.04 | -72.58 | 1 | 7 | 0 | 85 | 283.328 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.74 | 3.65 | -54.17 | 0 | 7 | -1 | 84 | 282.32 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.74 | 4.13 | -50.47 | 2 | 7 | 1 | 82 | 284.336 | 4 | ↓ |