In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2009 | 21 | No |
Popular Name: (1S)-2-[[(3S)-1,1-dioxothiolan-3-yl]amino]-1-(4-methylsulfonylphenyl)ethanol (1S)-2-[[(3S)-1,1-dioxothiolan-3…
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) | -0.70 | -1.74 | -77.38 | 3 | 6 | 1 | 105 | 334.439 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.70 | -2.88 | -23.3 | 2 | 6 | 0 | 101 | 333.431 | 5 | ↓ |