In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 34 | Yes |
Popular Name: N-[2-(m-tolyl)-5-phenyl-pyrazol-3-yl]-N'-[2-(2-pyridyl)ethyl]butanediamide N-[2-(m-tolyl)-5-phenyl-pyrazol-…
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) | 3.55 | 11.88 | -18.48 | 2 | 7 | 0 | 89 | 453.546 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.55 | 12.23 | -46.29 | 3 | 7 | 1 | 90 | 454.554 | 9 | ↓ |