In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 34 | Yes |
Popular Name: 8-[(4-benzylpiperazin-1-yl)methyl]-3-(4-bromophenyl)-7-hydroxy-2-methyl-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) | 5.56 | 12.04 | -48.94 | 2 | 5 | 1 | 58 | 520.447 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.56 | 12.01 | -48.55 | 2 | 5 | 1 | 58 | 520.447 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.56 | 9.74 | -10.15 | 1 | 5 | 0 | 57 | 519.439 | 5 | ↓ |