| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 19 | No |
Popular Name: (3E)-6-chloro-7-methyl-3-(5-oxo-2-thioxo-imidazolidin-4-ylidene)indolin-2-one (3E)-6-chloro-7-methyl-3-(5-oxo-…
| 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) | 2.55 | 0.05 | -100.62 | 1 | 5 | -2 | 88 | 291.719 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.09 | 2.09 | -34.43 | 2 | 5 | -1 | 85 | 292.727 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | -0.76 | -41.92 | 2 | 5 | -1 | 85 | 292.727 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.09 | 1.29 | -9.99 | 3 | 5 | 0 | 82 | 293.735 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
