In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 19 | Yes |
Popular Name: 1-[1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]-4-piperidyl]-N,N-dimethyl-methanamine 1-[1-[(5-chloro-1,3-dimethyl-pyr…
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) | 1.95 | 8.67 | -95.44 | 2 | 4 | 2 | 27 | 286.851 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.95 | 6.45 | -38 | 1 | 4 | 1 | 26 | 285.843 | 4 | ↓ |