In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 19 | No |
Popular Name: [4-(1,1-dioxo-1,4-thiazinan-4-yl)-1-propyl-4-piperidyl]methanamine [4-(1,1-dioxo-1,4-thiazinan-4-yl…
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) | -0.22 | 0.96 | -130.81 | 4 | 5 | 2 | 69 | 291.461 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.22 | 0.11 | -48.25 | 3 | 5 | 1 | 68 | 290.453 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.