In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 19 | Yes |
Popular Name: 1-(3,5-dibromo-4-methoxy-phenyl)-N-[[(2S)-1,4-dioxan-2-yl]methyl]methanamine 1-(3,5-dibromo-4-methoxy-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) | 2.66 | 5.3 | -49.51 | 2 | 4 | 1 | 44 | 396.099 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.66 | 3.94 | -5.23 | 1 | 4 | 0 | 40 | 395.091 | 5 | ↓ |