In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2010 | 21 | Yes |
Popular Name: 2-bromo-6-[[(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)amino]methyl]phenol 2-bromo-6-[[(6-chloro-2,3-dihydr…
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) | 3.80 | 4.69 | -7.71 | 2 | 4 | 0 | 51 | 370.63 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.80 | 5.44 | -39.93 | 1 | 4 | -1 | 54 | 369.622 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.