In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 20 | Yes |
Popular Name: (1R,4S,5S,6R)-6-(2-diethylaminoethylcarbamoyl)bicyclo[2.2.1]hept-2-ene-5-carboxylic (1R,4S,5S,6R)-6-(2-diethylaminoe…
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) | 1.44 | 6.01 | -58.63 | 2 | 5 | 0 | 74 | 280.368 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.44 | 3.72 | -54.24 | 1 | 5 | -1 | 72 | 279.36 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.44 | 4.89 | -47.3 | 3 | 5 | 1 | 71 | 281.376 | 7 | ↓ |