In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: [5-(4-chloro-3-ethyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methanamine [5-(4-chloro-3-ethyl-phenoxy)-1,…
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) | 3.12 | 4.87 | -44.43 | 3 | 4 | 1 | 55 | 280.779 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.12 | 4.47 | -5.61 | 2 | 4 | 0 | 53 | 279.771 | 4 | ↓ |