| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 4th, 2010 | 21 | Yes |
Popular Name: N-(1,3-benzothiazol-2-yl)-5-(3-hydroxyprop-1-ynyl)thiophene-2-carboxamide N-(1,3-benzothiazol-2-yl)-5-(3-h…
| 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) | 3.09 | 5.25 | -12.79 | 2 | 4 | 0 | 62 | 314.391 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 3.4 | -49.55 | 1 | 4 | -1 | 69 | 313.383 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
