In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 23 | Yes |
Popular Name: 7-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]thiazolo[3,2-a]pyrimidin-5-one 7-[[1,3-benzodioxol-5-ylmethyl(m…
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) | 2.12 | 5.81 | -38.77 | 1 | 6 | 1 | 57 | 330.389 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 5.41 | -15.19 | 0 | 6 | 0 | 56 | 329.381 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.