| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 2010 | 36 | Yes |
Popular Name: BIX01294hydrochloridehydrate BIX01294hydrochloridehydrate
Find On: PubMed — Wikipedia — Google
CAS Number: 935693-62-2
| 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) | 1.05 | 15.12 | -177.01 | 4 | 8 | 3 | 69 | 495.692 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 12.82 | -38.32 | 2 | 8 | 1 | 66 | 493.676 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 10.57 | -12.9 | 1 | 8 | 0 | 65 | 492.668 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 14.83 | -97.62 | 3 | 8 | 2 | 67 | 494.684 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.