| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 20 | No |
Popular Name: (7S)-N,5,5-trimethyl-2-(1,4-thiazepan-4-yl)-6,7-dihydro-4H-1,3-benzothiazol-7-amine (7S)-N,5,5-trimethyl-2-(1,4-thia…
| 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) | 3.44 | 8.34 | -39.77 | 2 | 3 | 1 | 33 | 312.528 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 6.92 | -4.43 | 1 | 3 | 0 | 28 | 311.52 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.44 | 8.65 | -92.58 | 3 | 3 | 2 | 34 | 313.536 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
