| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 21 | Yes |
Popular Name: 2-[1-[(1-isopropylpyrazol-3-yl)methyl]benzimidazol-2-yl]ethanamine 2-[1-[(1-isopropylpyrazol-3-yl)m…
| 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) | 1.61 | 6.64 | -52.31 | 3 | 5 | 1 | 63 | 284.387 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 6.26 | -12.54 | 2 | 5 | 0 | 62 | 283.379 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.61 | 7.22 | -99.97 | 4 | 5 | 2 | 65 | 285.395 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
