| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 15 | Yes |
Popular Name: [4-[(4-methylpiperazin-1-yl)methyl]thiazol-2-yl]methanamine [4-[(4-methylpiperazin-1-yl)meth…
| 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) | -0.28 | 0.98 | -88.99 | 4 | 4 | 2 | 48 | 228.365 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.28 | -1.79 | -4.85 | 2 | 4 | 0 | 45 | 226.349 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.28 | -1.38 | -44.12 | 3 | 4 | 1 | 47 | 227.357 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.28 | 0.87 | -94 | 4 | 4 | 2 | 48 | 228.365 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
