| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 17th, 2011 | 13 | No |
Popular Name: 5-(3,4-dichloro-1H-pyrrol-2-yl)-1,2,4-triazole-3-thione 5-(3,4-dichloro-1H-pyrrol-2-yl)-…
| 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) | 1.47 | 3.61 | -10.66 | 1 | 4 | 0 | 54 | 233.083 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.47 | 3.05 | -31.94 | 0 | 4 | -1 | 53 | 232.075 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
