In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 16 | Yes |
Popular Name: N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-2-methoxy-ethanamine N-[(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) | 2.11 | 3.67 | -46.61 | 2 | 4 | 1 | 44 | 289.149 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 2.32 | -5.68 | 1 | 4 | 0 | 40 | 288.141 | 5 | ↓ |