In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 20 | Yes |
Popular Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-2-phenyl-ethanamine N-[(6-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) | 3.93 | 6.91 | -4.73 | 1 | 3 | 0 | 30 | 334.213 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.93 | 8.29 | -44.47 | 2 | 3 | 1 | 35 | 335.221 | 5 | ↓ |