| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 3rd, 2006 | 27 | No |
Popular Name: BRD-K86805864-001-01-7 BRD-K86805864-001-01-7
| 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) | 5.28 | 6.78 | -8.68 | 2 | 5 | 0 | 78 | 389.358 | 2 | ↓ |
| Ref Reference (pH 7) | 4.79 | 6.72 | -42.62 | 1 | 5 | -1 | 77 | 388.35 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.74 | 4.83 | -42.27 | 1 | 5 | -1 | 81 | 388.35 | 2 | ↓ |
| Hi High (pH 8-9.5) | 6.20 | 3.71 | -101.59 | 0 | 5 | -2 | 84 | 387.342 | 2 | ↓ |
| Hi High (pH 8-9.5) | 6.20 | 3.01 | -103.47 | 0 | 5 | -2 | 84 | 387.342 | 2 | ↓ |
| Mid Mid (pH 6-8) | 5.25 | 4.77 | -99.17 | 0 | 5 | -2 | 80 | 387.342 | 3 | ↓ |
| Mid Mid (pH 6-8) | 5.74 | 5.66 | -40.61 | 1 | 5 | -1 | 81 | 388.35 | 2 | ↓ |
| Mid Mid (pH 6-8) | 5.74 | 5.24 | -42.91 | 1 | 5 | -1 | 81 | 388.35 | 2 | ↓ |
| Mid Mid (pH 6-8) | 5.74 | 4.97 | -43.3 | 1 | 5 | -1 | 81 | 388.35 | 2 | ↓ |
