| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 17th, 2004 | 20 | No |
Popular Name: 3-Hydroxybenzo[b]naphtho[2,3-d]furan-6,11-dione 3-Hydroxybenzo[b]naphtho[2,3-d]f…
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CAS Number: 97620-82-1
| 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) | 3.15 | -0.37 | -10.68 | 1 | 4 | 0 | 67 | 264.236 | 0 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80156-1-O | HL-60 (Promyeloblast Leukemia Cells) (cluster #1 Of 12), Other | Other | 7780 | 0.36 | Functional ≤ 10μM |
| Z81052-1-O | Human Tumour Cell Line (cluster #1 Of 1), Other | Other | 10000 | 0.35 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80156 | Z80156 | HL-60 (Promyeloblast Leukemia Cells) | 7780 | 0.36 | Functional ≤ 10μM |
| Z81052 | Z81052 | Human Tumour Cell Line | 10000 | 0.35 | Functional ≤ 10μM |
