| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 18th, 2013 | 28 | No |
Popular Name: Sudan Black B Sudan Black B
Find On: PubMed — Wikipedia — Google
CAS Number: 4197-25-5
| 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) | 4.16 | 6.86 | -23.63 | 3 | 6 | 1 | 75 | 371.468 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.16 | 9.23 | -92.42 | 4 | 6 | 2 | 80 | 372.476 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.16 | 6.33 | -98.66 | 4 | 6 | 2 | 80 | 372.476 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.16 | 8.09 | -92 | 4 | 6 | 2 | 80 | 372.476 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.16 | 7.96 | -93.06 | 4 | 6 | 2 | 80 | 372.476 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.