| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: (1S,2R)-2-[methyl-[(1S)-1-(4-pyridyl)ethyl]carbamoyl]cyclohexanecarboxylic (1S,2R)-2-[methyl-[(1S)-1-(4-pyr…
| 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) | 1.73 | 7.48 | -59.5 | 0 | 5 | -1 | 73 | 289.355 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.73 | 7.94 | -80.98 | 1 | 5 | 0 | 75 | 290.363 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.73 | 6.55 | -43.46 | 2 | 5 | 1 | 72 | 291.371 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.73 | 6.09 | -13.16 | 1 | 5 | 0 | 71 | 290.363 | 4 | ↓ |
