| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 17 | Yes |
Popular Name: N-[[4-[(2-methylimidazol-1-yl)methyl]thiazol-2-yl]methyl]propan-1-amine 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) | 1.02 | 6.78 | -84.29 | 3 | 4 | 2 | 49 | 252.387 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.02 | 5.04 | -10.46 | 1 | 4 | 0 | 43 | 250.371 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.02 | 6.31 | -44.71 | 2 | 4 | 1 | 47 | 251.379 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
