In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 21 | Yes |
Popular Name: N-[[5-phenyl-1-(4-pyridyl)pyrazol-4-yl]methyl]ethanamine N-[[5-phenyl-1-(4-pyridyl)pyrazo…
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) | 2.33 | 8.01 | -43.52 | 2 | 4 | 1 | 47 | 279.367 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.33 | 7.25 | -6.27 | 1 | 4 | 0 | 43 | 278.359 | 5 | ↓ |