| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 16 | Yes |
Popular Name: N-[[4-[(2-methylimidazol-1-yl)methyl]thiazol-2-yl]methyl]ethanamine N-[[4-[(2-methylimidazol-1-yl)me…
| 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) | 0.51 | 6.03 | -82.86 | 3 | 4 | 2 | 49 | 238.36 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.51 | 4.27 | -10.55 | 1 | 4 | 0 | 43 | 236.344 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.51 | 5.55 | -43.96 | 2 | 4 | 1 | 47 | 237.352 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
