In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2009 | 27 | Yes |
Popular Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-propyl-amino]-N-(o-tolyl)acetamide 2-[(6-bromo-2,3-dihydro-1,4-benz…
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) | 4.44 | 10.34 | -43.8 | 2 | 5 | 1 | 52 | 434.354 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.44 | 8.04 | -13.74 | 1 | 5 | 0 | 51 | 433.346 | 7 | ↓ |