In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 18 | No |
Popular Name: 1-methyl-3-(5-oxo-2-thioxo-4-imidazolidinylidene)-1,3-dihydro-2H-indol-2-one 1-methyl-3-(5-oxo-2-thioxo-4-imi…
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) | 1.58 | 0.97 | -110.29 | 0 | 5 | -2 | 77 | 257.274 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.58 | 0.17 | -47.24 | 1 | 5 | -1 | 74 | 258.282 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.13 | 3.02 | -40.16 | 1 | 5 | -1 | 74 | 258.282 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.