| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 21 | Yes |
Popular Name: 2-tert-butyl-1-[(3S)-1-methyl-3-piperidyl]benzimidazol-5-amine 2-tert-butyl-1-[(3S)-1-methyl-3-…
| 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) | 2.78 | 7.75 | -48.17 | 3 | 4 | 1 | 48 | 287.431 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 5.37 | -7.9 | 2 | 4 | 0 | 47 | 286.423 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 8.13 | -83.65 | 4 | 4 | 2 | 50 | 288.439 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
