In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 18 | No |
Popular Name: (1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)thiazol-5-yl]-N-ethyl-ethanamine (1S)-1-[2-(1,1-dioxo-1,4-thiazin…
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) | 1.09 | 2.94 | -47.65 | 2 | 5 | 1 | 67 | 290.434 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.09 | 1.78 | -11.92 | 1 | 5 | 0 | 62 | 289.426 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.