| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2008 | 27 | Yes |
Popular Name: N-[2-(4-ethylpiperazin-1-yl)ethyl]-5-(4-methoxyphenyl)-4-methyl-1,1-dioxo-isothiazol-3-amine N-[2-(4-ethylpiperazin-1-yl)ethy…
None
| 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) | 2.00 | 3.15 | -41.14 | 1 | 7 | 0 | 78 | 392.525 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 1.81 | -21.53 | 1 | 7 | 0 | 74 | 392.525 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 4.12 | -55.39 | 2 | 7 | 1 | 75 | 393.533 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 4.12 | -63.76 | 2 | 7 | 1 | 75 | 393.533 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
