| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 21 | Yes |
Popular Name: [5-(4-chloro-5-isopropyl-2-methyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methanamine [5-(4-chloro-5-isopropyl-2-methy…
| 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) | 3.62 | 6.16 | -44.41 | 3 | 4 | 1 | 55 | 308.833 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.62 | 5.76 | -5.43 | 2 | 4 | 0 | 53 | 307.825 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
