| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2006 | 14 | Yes |
Popular Name: Thiazolo[4,5-b]pyridin-5(4H)-one, 6-bromo-7-hydroxy-2-(methylamino)- Thiazolo[4,5-b]pyridin-5(4H)-one…
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CAS Number: 893756-63-3
| 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) | 1.56 | 0.47 | -44.58 | 2 | 5 | -1 | 81 | 275.107 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.59 | -1.41 | -90.55 | 0 | 5 | -2 | 79 | 274.099 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.14 | -1.53 | -88.51 | 0 | 5 | -2 | 79 | 274.099 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.14 | -1.52 | -88.5 | 0 | 5 | -2 | 79 | 274.099 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.14 | -0.01 | -42.22 | 2 | 5 | 0 | 78 | 276.115 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.14 | 0 | -42.18 | 2 | 5 | 0 | 78 | 276.115 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.59 | -0.72 | -37.92 | 1 | 5 | -1 | 77 | 275.107 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.