| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 23 | Yes |
Popular Name: 3-chloro-7-hydroxy-8-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]chromen-4-one 3-chloro-7-hydroxy-8-[[4-(2-hydr…
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| 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) | 1.38 | 1.34 | -49.61 | 3 | 6 | 1 | 78 | 339.799 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.38 | -0.34 | -43.16 | 1 | 6 | -1 | 80 | 337.783 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | 1.42 | -45.49 | 3 | 6 | 1 | 78 | 339.799 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | -0.91 | -11.26 | 2 | 6 | 0 | 77 | 338.791 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
