In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | Yes |
Popular Name: (1S,2R)-2-[2-cyanoethyl(isobutyl)carbamoyl]cyclopropanecarboxylic (1S,2R)-2-[2-cyanoethyl(isobutyl…
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) | 0.59 | 7.46 | -60.57 | 0 | 5 | -1 | 84 | 237.279 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.59 | 6.01 | -17.61 | 1 | 5 | 0 | 81 | 238.287 | 6 | ↓ |