In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 23 | Yes |
Popular Name: 4-[[6-(2-cyclohexen-1-ylethylamino)-3-pyridyl]amino]-4-oxo-butanoic 4-[[6-(2-cyclohexen-1-ylethylami…
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) | 2.41 | 6.65 | -50.67 | 2 | 6 | -1 | 94 | 316.381 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 7.12 | -68.87 | 3 | 6 | 0 | 95 | 317.389 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.41 | 6 | -43.18 | 4 | 6 | 1 | 93 | 318.397 | 8 | ↓ |