In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2008 | 20 | No |
Popular Name: (NE)-N-[(5Z)-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-thiazolidin-2-ylidene]acetamide (NE)-N-[(5Z)-5-(1,3-benzodioxol-…
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) | 2.20 | 2.41 | -12.63 | 1 | 6 | 0 | 81 | 290.3 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.20 | 3.51 | -37.97 | 2 | 6 | 1 | 82 | 291.308 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.