| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 2nd, 2011 | 19 | No |
Popular Name: (5S)-3-(1-isoquinolylmethyl)-5-methyl-2-thioxo-imidazolidin-4-one (5S)-3-(1-isoquinolylmethyl)-5-m…
| 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) | 1.80 | 6.47 | -13.67 | 1 | 4 | 0 | 45 | 271.345 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 7.53 | -32.66 | 2 | 4 | 1 | 46 | 272.353 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
