| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 18 | Yes |
Popular Name: 5-(5-bromoindoline-1-carbonyl)-1,2-dihydro-1,2,4-triazol-3-one 5-(5-bromoindoline-1-carbonyl)-1…
| 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) | 1.05 | 3.53 | -9.14 | 2 | 6 | 0 | 82 | 309.123 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.51 | 1.45 | -44.68 | 1 | 6 | -1 | 85 | 308.115 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.51 | 1.94 | -22.69 | 2 | 6 | 0 | 86 | 309.123 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
