| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 20 | Yes |
Popular Name: 2-methyl-N-(1-prop-2-ynyl-4-piperidyl)-1H-benzimidazol-5-amine 2-methyl-N-(1-prop-2-ynyl-4-pipe…
| 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) | 2.60 | 4.95 | -9.21 | 2 | 4 | 0 | 44 | 268.364 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.60 | 5.39 | -29.39 | 3 | 4 | 1 | 45 | 269.372 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.60 | 7.23 | -44.97 | 3 | 4 | 1 | 45 | 269.372 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.60 | 7.67 | -77.3 | 4 | 4 | 2 | 46 | 270.38 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
