| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2009 | 20 | No |
Popular Name: 6-Nitro-3-(4-pyridyl)coumarin; BRN 0889282; Coumarin, 6-nitro-3-(4-pyridyl)-; LS-55266 6-Nitro-3-(4-pyridyl)coumarin; B…
| 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) | 2.38 | 8.47 | -11.7 | 0 | 6 | 0 | 89 | 268.228 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.38 | 8.94 | -44.77 | 1 | 6 | 1 | 90 | 269.236 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
