| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 17 | Yes |
Popular Name: N-[2-(4-thiazol-2-ylpiperazin-1-yl)ethyl]prop-2-en-1-amine N-[2-(4-thiazol-2-ylpiperazin-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) | 1.06 | 4.29 | -43.57 | 2 | 4 | 1 | 36 | 253.395 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.06 | 2.92 | -4.83 | 1 | 4 | 0 | 31 | 252.387 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.06 | 4.73 | -79.09 | 3 | 4 | 2 | 37 | 254.403 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
