| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 20 | Yes |
Popular Name: 2-[4-(1,3-benzothiazol-2-yl)-1,4-diazepan-1-yl]acetamide 2-[4-(1,3-benzothiazol-2-yl)-1,4…
| 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) | 1.49 | 5.73 | -45.11 | 3 | 5 | 1 | 64 | 291.4 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.49 | 4.11 | -12.19 | 2 | 5 | 0 | 62 | 290.392 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
