In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2004 | 23 | No |
Popular Name: 3-[4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]-1,3-dihydro-2H-indol-2-one 3-[4-oxo-2-(phenylimino)-1,3-thi…
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) | 3.92 | 5.7 | -43.56 | 1 | 5 | -1 | 77 | 320.353 | 2 | ↓ |
Ref Reference (pH 7) | 4.41 | 6.19 | -8.74 | 2 | 5 | 0 | 78 | 321.361 | 1 | ↓ |
Hi High (pH 8-9.5) | 5.32 | 2 | -110.15 | 0 | 5 | -2 | 84 | 319.345 | 1 | ↓ |
Hi High (pH 8-9.5) | 5.32 | 2.68 | -107.93 | 0 | 5 | -2 | 84 | 319.345 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.87 | 3.96 | -47.38 | 1 | 5 | -1 | 81 | 320.353 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.87 | 3.82 | -45.27 | 1 | 5 | -1 | 81 | 320.353 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.87 | 4.22 | -44.36 | 1 | 5 | -1 | 81 | 320.353 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.87 | 4.65 | -45.55 | 1 | 5 | -1 | 81 | 320.353 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.38 | 3.76 | -105.72 | 0 | 5 | -2 | 80 | 319.345 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.92 | 6.09 | -17.67 | 2 | 5 | 0 | 75 | 321.361 | 2 | ↓ |