In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 20 | Yes |
Popular Name: 1-[2-[butyl(ethyl)amino]-2-oxo-ethyl]cycloheptanecarboxylic 1-[2-[butyl(ethyl)amino]-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) | 3.49 | 10.39 | -63.6 | 0 | 4 | -1 | 60 | 282.404 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.49 | 8.65 | -12.76 | 1 | 4 | 0 | 58 | 283.412 | 7 | ↓ |