| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2008 | 31 | Yes |
Popular Name: 3-(3,4-dimethoxyphenyl)-7-hydroxy-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]chromen-4-one 3-(3,4-dimethoxyphenyl)-7-hydrox…
| 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) | 3.00 | 6.97 | -56.86 | 2 | 7 | 1 | 77 | 425.505 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.00 | 5.13 | -47.63 | 0 | 7 | -1 | 78 | 423.489 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 6.84 | -60.39 | 2 | 7 | 1 | 77 | 425.505 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 4.51 | -16.36 | 1 | 7 | 0 | 75 | 424.497 | 5 | ↓ |
