In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 35 | Yes |
Popular Name: 8-[(4-benzylpiperazin-1-yl)methyl]-7-hydroxy-3-(4-methoxyphenoxy)chromen-4-one 8-[(4-benzylpiperazin-1-yl)methy…
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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) | 4.54 | 9.67 | -52.25 | 2 | 7 | 1 | 77 | 473.549 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.54 | 8.16 | -44.58 | 0 | 7 | -1 | 78 | 471.533 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.54 | 7.4 | -14 | 1 | 7 | 0 | 75 | 472.541 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.54 | 9.65 | -50.13 | 2 | 7 | 1 | 77 | 473.549 | 7 | ↓ |