| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 19 | No |
Popular Name: (3Z)-1,5-dimethyl-3-(5-oxo-2-thioxo-imidazolidin-4-ylidene)indolin-2-one (3Z)-1,5-dimethyl-3-(5-oxo-2-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) | 2.01 | 1.64 | -111.66 | 0 | 5 | -2 | 77 | 271.301 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 2.88 | -10.57 | 2 | 5 | 0 | 71 | 273.317 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 3.68 | -40.54 | 1 | 5 | -1 | 74 | 272.309 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 0.83 | -48.75 | 1 | 5 | -1 | 74 | 272.309 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
