| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 21 | No |
Popular Name: (7R)-N-ethyl-5,5-dimethyl-2-(1,4-thiazepan-4-yl)-6,7-dihydro-4H-1,3-benzothiazol-7-amine (7R)-N-ethyl-5,5-dimethyl-2-(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) | 3.82 | 9.19 | -38.45 | 2 | 3 | 1 | 33 | 326.555 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.82 | 7.85 | -4.34 | 1 | 3 | 0 | 28 | 325.547 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.82 | 9.5 | -91.66 | 3 | 3 | 2 | 34 | 327.563 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
