In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 18 | Yes |
Popular Name: (1R,6S)-6-[[2-(ethylamino)-2-oxo-ethyl]carbamoyl]cyclohex-3-ene-1-carboxylic (1R,6S)-6-[[2-(ethylamino)-2-oxo…
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) | 0.31 | 3.12 | -49.72 | 2 | 6 | -1 | 98 | 253.278 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.31 | 0.97 | -10.94 | 3 | 6 | 0 | 95 | 254.286 | 5 | ↓ |