| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 32 | No |
Popular Name: BRD-A88208128-003-01-2 BRD-A88208128-003-01-2
| 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) | -2.01 | 0.89 | -53.43 | 6 | 10 | 0 | 182 | 444.44 | 1 | ↓ |
| Hi High (pH 8-9.5) | -1.27 | 0.36 | -25.86 | 5 | 10 | 0 | 181 | 443.432 | 2 | ↓ |
| Hi High (pH 8-9.5) | -2.01 | 1.51 | -131.76 | 4 | 10 | -2 | 184 | 442.424 | 1 | ↓ |
| Hi High (pH 8-9.5) | -1.27 | 1.35 | -113.58 | 4 | 10 | 0 | 184 | 442.424 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.27 | 1.74 | -75.74 | 5 | 10 | 0 | 185 | 443.432 | 2 | ↓ |
| Hi High (pH 8-9.5) | -2.01 | 1.88 | -92.98 | 5 | 10 | -1 | 185 | 443.432 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.27 | 1.64 | -89.65 | 5 | 10 | -1 | 185 | 443.432 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.27 | 0.98 | -48.57 | 6 | 10 | 0 | 182 | 444.44 | 2 | ↓ |
| Mid Mid (pH 6-8) | -2.01 | 0.2 | -41.17 | 7 | 10 | 1 | 180 | 445.448 | 1 | ↓ |
| Mid Mid (pH 6-8) | -2.01 | 0.52 | -66.8 | 5 | 10 | -1 | 181 | 443.432 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.27 | 0.75 | -57.17 | 6 | 10 | 0 | 182 | 444.44 | 2 | ↓ |
