In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 20 | No |
Popular Name: (1R,2R,4R)-4-tert-butyl-2-(1,1-dioxo-1,4-thiazinan-4-yl)cyclohexanecarbonitrile (1R,2R,4R)-4-tert-butyl-2-(1,1-d…
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) | 2.49 | 4.07 | -14.21 | 0 | 4 | 0 | 61 | 298.452 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.49 | 5.76 | -58.01 | 1 | 4 | 1 | 62 | 299.46 | 2 | ↓ |