In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 17 | No |
Popular Name: N-[(5,5-dioxo-3,4,6,7-tetrahydrothiopyrano[3,4-d]imidazol-2-yl)methyl]-2-methoxy-ethanamine N-[(5,5-dioxo-3,4,6,7-tetrahydro…
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) | -0.54 | -0.54 | -53.4 | 3 | 6 | 1 | 89 | 260.339 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.54 | -1.87 | -16.51 | 2 | 6 | 0 | 84 | 259.331 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.