In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2009 | 19 | No |
Popular Name: (2S)-3-sulfanyl-2-(2,6,6-trimethyl-4-oxo-5,7-dihydroindol-1-yl)propanoic (2S)-3-sulfanyl-2-(2,6,6-trimeth…
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) | 1.86 | 7.59 | -41.53 | 0 | 4 | -1 | 62 | 280.369 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.86 | 8.07 | -106.03 | 0 | 4 | -2 | 62 | 279.361 | 3 | ↓ |