In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: 4-[[(1R)-1-methyl-2-(1-piperidyl)ethyl]amino]-4-oxo-butanoic 4-[[(1R)-1-methyl-2-(1-piperidyl…
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) | 0.47 | 6.37 | -65.08 | 2 | 5 | 0 | 74 | 242.319 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.47 | 4.4 | -41.73 | 3 | 5 | 1 | 71 | 243.327 | 6 | ↓ |