In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 20th, 2010 | 21 | Yes |
Popular Name: (1S,4R,5S,6R)-6-(2-piperazin-1-ylethylcarbamoyl)bicyclo[2.2.1]hept-2-ene-5-carboxylic (1S,4R,5S,6R)-6-(2-piperazin-1-y…
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) | -0.01 | 3.24 | -65.6 | 3 | 6 | 0 | 89 | 293.367 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.01 | 1.49 | -49.34 | 4 | 6 | 1 | 86 | 294.375 | 5 | ↓ |