| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 20 | Yes |
Popular Name: 4-chloro-2-[[(1-isopropyl-3,5-dimethyl-pyrazol-4-yl)amino]methyl]phenol 4-chloro-2-[[(1-isopropyl-3,5-di…
| 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) | 3.35 | 5.02 | -7.44 | 2 | 4 | 0 | 50 | 293.798 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.35 | 5.78 | -41.08 | 1 | 4 | -1 | 53 | 292.79 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.35 | 5.16 | -26.84 | 3 | 4 | 1 | 51 | 294.806 | 4 | ↓ |
