| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 15 | Yes |
Popular Name: [2-(4-methyl-1,4-diazepan-1-yl)thiazol-5-yl]methanol [2-(4-methyl-1,4-diazepan-1-yl)t…
| 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) | 0.83 | 3.85 | -40.28 | 2 | 4 | 1 | 41 | 228.341 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.83 | 1.88 | -7.5 | 1 | 4 | 0 | 40 | 227.333 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.83 | 4.32 | -87.27 | 3 | 4 | 2 | 42 | 229.349 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
