In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 29 | Yes |
Popular Name: 8-(azepan-1-ylmethyl)-3-(3,5-dimethylphenoxy)-7-hydroxy-chromen-4-one 8-(azepan-1-ylmethyl)-3-(3,5-dim…
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) | 5.43 | 11.23 | -55.63 | 2 | 5 | 1 | 64 | 394.491 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.43 | 11.86 | -31.61 | 1 | 5 | 0 | 67 | 393.483 | 4 | ↓ |