In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 19th, 2008 | 32 | No |
Popular Name: (E)-3-[4-[[2-(oxo-propyl-BLAHyl)sulfanylacetyl]amino]phenyl]prop-2-enoic (E)-3-[4-[[2-(oxo-propyl-BLAHyl)…
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) | 4.04 | 11.54 | -63.01 | 1 | 7 | -1 | 104 | 468.58 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.