| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 20 | Yes |
Popular Name: (7S)-N-ethyl-2-(4-ethylpiperazin-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-amine (7S)-N-ethyl-2-(4-ethylpiperazin…
| 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) | 2.54 | 8.31 | -85.02 | 3 | 4 | 2 | 37 | 296.484 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 4.75 | -6.15 | 1 | 4 | 0 | 31 | 294.468 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 6.49 | -86.96 | 3 | 4 | 2 | 37 | 296.484 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 6.1 | -37.71 | 2 | 4 | 1 | 36 | 295.476 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 8.71 | -164.94 | 4 | 4 | 3 | 38 | 297.492 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
