In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 30 | Yes |
Popular Name: 2-benzyloxy-1,8-dihydroxy-3,10-dimethoxy-5H-benzo[d][2]benzoxepin-7-one 2-benzyloxy-1,8-dihydroxy-3,10-d…
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) | 4.37 | 5.9 | -14.64 | 2 | 7 | 0 | 94 | 408.406 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.37 | 6.69 | -55.34 | 1 | 7 | -1 | 97 | 407.398 | 5 | ↓ |