In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 18 | Yes |
Popular Name: 4-(8-bromo-2,3-dihydro-1,4-benzodioxin-6-yl)imidazole-1,5-diamine 4-(8-bromo-2,3-dihydro-1,4-benzo…
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) | 1.10 | 4.63 | -36.89 | 5 | 6 | 1 | 90 | 312.147 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.10 | 4.21 | -10.6 | 4 | 6 | 0 | 88 | 311.139 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.