In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 18 | Yes |
Popular Name: 1-[(1S)-2-amino-1-(1-methylpyrazol-4-yl)ethyl]-N,N-dimethyl-piperidin-4-amine 1-[(1S)-2-amino-1-(1-methylpyraz…
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 | 2.77 | -92.67 | 4 | 5 | 2 | 53 | 253.394 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.47 | 2.6 | -37.48 | 3 | 5 | 1 | 52 | 252.386 | 4 | ↓ |