In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 16 | Yes |
Popular Name: 1-[2-(2-aminoethylamino)-2-oxo-ethyl]cyclohexanecarboxylic 1-[2-(2-aminoethylamino)-2-oxo-e…
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) | -0.27 | 2.8 | -82.58 | 4 | 5 | 0 | 97 | 228.292 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.27 | 2.42 | -57.82 | 3 | 5 | -1 | 95 | 227.284 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.27 | 0.8 | -55.59 | 5 | 5 | 1 | 94 | 229.3 | 5 | ↓ |