In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2010 | 21 | Yes |
Popular Name: N'-cyclohexyl-N'-methyl-N-[2-[(2R)-1-methyl-2-piperidyl]ethyl]propane-1,3-diamine N'-cyclohexyl-N'-methyl-N-[2-[(2…
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) | 3.15 | 10.97 | -182.51 | 4 | 3 | 3 | 25 | 298.539 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.15 | 9.62 | -77.06 | 3 | 3 | 2 | 21 | 297.531 | 8 | ↓ |