| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 19 | No |
Popular Name: 4-(chloromethyl)-2-[2-(4-isobutylpiperazin-1-yl)ethyl]thiazole 4-(chloromethyl)-2-[2-(4-isobuty…
| 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) | 2.64 | 7.12 | -37.1 | 1 | 3 | 1 | 21 | 302.895 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.64 | 5.15 | -4.74 | 0 | 3 | 0 | 19 | 301.887 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
