| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 20 | Yes |
Popular Name: (7S)-2-(4-ethylpiperazin-1-yl)-5,5-dimethyl-6,7-dihydro-4H-1,3-benzothiazol-7-ol (7S)-2-(4-ethylpiperazin-1-yl)-5…
| 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) | 2.50 | 6.05 | -40.58 | 2 | 4 | 1 | 41 | 296.46 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.50 | 3.83 | -5.85 | 1 | 4 | 0 | 40 | 295.452 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.50 | 4.22 | -24.75 | 2 | 4 | 1 | 41 | 296.46 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.50 | 6.45 | -90.73 | 3 | 4 | 2 | 42 | 297.468 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
