In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2009 | 18 | Yes |
Popular Name: N-[[1,3-dimethyl-5-[(2R)-2-methyl-1-piperidyl]pyrazol-4-yl]methyl]ethanamine N-[[1,3-dimethyl-5-[(2R)-2-methy…
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) | 1.94 | 6.96 | -37.88 | 2 | 4 | 1 | 38 | 251.398 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.94 | 5.54 | -3.74 | 1 | 4 | 0 | 33 | 250.39 | 4 | ↓ |