In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 19 | No |
Popular Name: 4-[(1S)-1-[[(3R)-1,1-dioxothiolan-3-yl]amino]ethyl]-2-methoxy-phenol 4-[(1S)-1-[[(3R)-1,1-dioxothiola…
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) | 0.91 | 1.11 | -65.26 | 3 | 5 | 1 | 80 | 286.373 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.91 | 1.91 | -86.53 | 2 | 5 | 0 | 83 | 285.365 | 4 | ↓ |