In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 22 | No |
Popular Name: 4-(2-oxo-2-piperazin-1-yl-ethyl)-5-phenyl-1,4-thiazin-3-one 4-(2-oxo-2-piperazin-1-yl-ethyl)…
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) | 0.20 | 6.52 | -53.88 | 2 | 5 | 1 | 57 | 318.422 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.20 | 5.23 | -12.58 | 1 | 5 | 0 | 53 | 317.414 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.