In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: 1-(2-bromo-4,5-dimethoxy-phenyl)-N-(4-pyridylmethyl)methanamine 1-(2-bromo-4,5-dimethoxy-phenyl)…
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 | 6.27 | -49.41 | 2 | 4 | 1 | 48 | 338.225 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.99 | 4.91 | -8.29 | 1 | 4 | 0 | 43 | 337.217 | 6 | ↓ |