In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | No |
Popular Name: N-methyl-N-[2-[methyl-(1-methyl-4-piperidyl)amino]ethyl]-3-oxo-butanamide N-methyl-N-[2-[methyl-(1-methyl-…
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) | -0.07 | 6.64 | -44.3 | 1 | 5 | 1 | 45 | 270.397 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.68 | 5.5 | -55.73 | 1 | 5 | 0 | 51 | 269.389 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.07 | 9.04 | -108.18 | 2 | 5 | 2 | 46 | 271.405 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.07 | 6.57 | -46.79 | 1 | 5 | 1 | 45 | 270.397 | 6 | ↓ |