In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 24 | No |
Popular Name: 6-[(5,5-dimethyl-3-oxo-2-pentanoyl-1-cyclohexenyl)amino]hexanoic 6-[(5,5-dimethyl-3-oxo-2-pentano…
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) | 3.26 | 10.36 | -98.48 | 0 | 5 | 0 | 87 | 336.452 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.84 | 8.76 | -103.46 | 0 | 5 | -2 | 93 | 335.444 | 9 | ↓ |