In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2010 | 14 | No |
Popular Name: 3-[(1S,6R)-6-formyl-6-methyl-cyclohex-2-en-1-yl]propanoic 3-[(1S,6R)-6-formyl-6-methyl-cyc…
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) | 1.58 | 6.59 | -49.25 | 0 | 3 | -1 | 57 | 195.238 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.58 | 4.61 | -9.79 | 1 | 3 | 0 | 54 | 196.246 | 4 | ↓ |