In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 31 | Yes |
Popular Name: N-[2-[[(2R)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanoyl]amino]ethyl]benzamide N-[2-[[(2R)-2-[(1,1-dioxo-1,2-be…
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) | 1.89 | 4.27 | -27.79 | 3 | 8 | 0 | 117 | 442.541 | 10 | ↓ |
Hi High (pH 8-9.5) | 1.89 | 3.33 | -52.3 | 2 | 8 | -1 | 119 | 441.533 | 10 | ↓ |