In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 17 | Yes |
Popular Name: 4-(7-bromo-1,3-benzodioxol-5-yl)imidazole-1,5-diamine 4-(7-bromo-1,3-benzodioxol-5-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) | 1.29 | 4.09 | -38.42 | 5 | 6 | 1 | 90 | 298.12 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 3.67 | -9.7 | 4 | 6 | 0 | 88 | 297.112 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.