| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 19 | Yes |
Popular Name: 2-[1-(1,3-benzothiazol-2-ylmethyl)triazol-4-yl]propan-2-amine 2-[1-(1,3-benzothiazol-2-ylmethy…
| 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) | 2.04 | 3.59 | -60.56 | 3 | 5 | 1 | 71 | 274.373 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.04 | 3.34 | -14.92 | 2 | 5 | 0 | 70 | 273.365 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
