In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | No |
Popular Name: (3R)-1,1-dioxo-N-(quinoxalin-2-ylmethyl)thiolan-3-amine (3R)-1,1-dioxo-N-(quinoxalin-2-y…
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) | 1.05 | 1.41 | -65.81 | 2 | 5 | 1 | 77 | 278.357 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.05 | 0.22 | -17.15 | 1 | 5 | 0 | 72 | 277.349 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.