In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2010 | 17 | No |
Popular Name: 3-(1-oxo-1,4-thiazinan-4-yl)-1-piperazin-1-yl-propan-1-one 3-(1-oxo-1,4-thiazinan-4-yl)-1-p…
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) | -1.88 | 0.22 | -57.5 | 2 | 5 | 1 | 57 | 260.383 | 3 | ↓ |
Mid Mid (pH 6-8) | -1.88 | -1.11 | -16.12 | 1 | 5 | 0 | 53 | 259.375 | 3 | ↓ |
Lo Low (pH 4.5-6) | -1.88 | 2.33 | -115.31 | 3 | 5 | 2 | 58 | 261.391 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.