In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 16 | Yes |
Popular Name: (1S,4R,5S,6R)-6-(2-aminoethylcarbamoyl)bicyclo[2.2.1]hept-2-ene-5-carboxylic (1S,4R,5S,6R)-6-(2-aminoethylcar…
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) | -0.54 | 2.13 | -60.41 | 4 | 5 | 0 | 97 | 224.26 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.54 | 1.74 | -49.65 | 3 | 5 | -1 | 95 | 223.252 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.54 | 0.17 | -54.03 | 5 | 5 | 1 | 94 | 225.268 | 4 | ↓ |