| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 21 | Yes |
Popular Name: [6-(4-isobutylpiperazin-1-yl)-1,3-benzothiazol-2-yl]methanamine [6-(4-isobutylpiperazin-1-yl)-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) | 2.38 | 5.43 | -93.72 | 4 | 4 | 2 | 48 | 306.479 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.38 | 3.04 | -6.35 | 2 | 4 | 0 | 45 | 304.463 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.38 | 3.43 | -49.03 | 3 | 4 | 1 | 47 | 305.471 | 4 | ↓ |
