In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 30th, 2006 | 29 | No |
Popular Name: allylsulfanyl-(3-hydroxy-4-methoxy-phenyl)-BLAHdione allylsulfanyl-(3-hydroxy-4-metho…
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) | 3.11 | 6.81 | -29.14 | 3 | 7 | 0 | 104 | 411.483 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.74 | -4.2 | -13.2 | 3 | 7 | 0 | 104 | 411.483 | 5 | ↓ |