In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: 1-[2-(2-cyanoethylamino)-2-oxo-ethyl]cyclohexanecarboxylic 1-[2-(2-cyanoethylamino)-2-oxo-e…
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) | 0.38 | 5.94 | -62.53 | 1 | 5 | -1 | 93 | 237.279 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.38 | 3.93 | -20.83 | 2 | 5 | 0 | 90 | 238.287 | 5 | ↓ |