In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 19 | Yes |
Popular Name: (S)-(2-bromo-4,5-dimethoxy-phenyl)-(4-pyridyl)methanamine (S)-(2-bromo-4,5-dimethoxy-pheny…
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) | 1.99 | 4.07 | -55.17 | 3 | 4 | 1 | 59 | 324.198 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.99 | 3.73 | -8.21 | 2 | 4 | 0 | 57 | 323.19 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.99 | 4.19 | -36.84 | 3 | 4 | 1 | 59 | 324.198 | 4 | ↓ |