| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 12th, 2013 | 10 | No |
Popular Name: (S)-4,5,6,7-Tetrahydro-2,6-benzothiazolediamine (S)-4,5,6,7-Tetrahydro-2,6-benzo…
Find On: PubMed — Wikipedia — Google
CAS Number: 106092-09-5
| 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) | 0.66 | 1.59 | -39.6 | 4 | 2 | 1 | 43 | 155.246 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.34 | 0.61 | -5.49 | 2 | 2 | 0 | 36 | 154.238 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.34 | 0.63 | -6.27 | 2 | 2 | 0 | 36 | 154.238 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.34 | 1.97 | -48.09 | 3 | 2 | 1 | 40 | 155.246 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.34 | 1.97 | -45.05 | 3 | 2 | 1 | 40 | 155.246 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.