In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 21 | Yes |
Popular Name: (1S,2R)-2-[[(1R,3R)-1-(hydroxymethyl)-3-methyl-cyclohexyl]carbamoyl]cyclohexanecarboxylic (1S,2R)-2-[[(1R,3R)-1-(hydroxyme…
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) | 2.17 | 5.2 | -59.76 | 2 | 5 | -1 | 89 | 296.387 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 3.76 | -9.28 | 3 | 5 | 0 | 87 | 297.395 | 4 | ↓ |