| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 32 | No |
Popular Name: BRD-A90165956-003-03-3 BRD-A90165956-003-03-3
None
| 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) | -0.43 | 1.19 | -91.13 | 6 | 10 | -1 | 188 | 443.432 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.43 | -1.16 | -132.94 | 5 | 10 | -2 | 187 | 442.424 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.87 | 0.02 | -50.89 | 7 | 10 | 0 | 186 | 444.44 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.46 | 2.25 | -66.8 | 6 | 10 | 0 | 182 | 444.44 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.43 | 0.61 | -121.71 | 6 | 10 | -1 | 188 | 443.432 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.43 | -0.39 | -115.45 | 5 | 10 | -2 | 187 | 442.424 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.43 | 0.12 | -49.53 | 7 | 10 | 0 | 186 | 444.44 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.