In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 21 | Yes |
Popular Name: 1-(3,5-dibromo-4-ethoxy-phenyl)-N-[(1-methyl-4-piperidyl)methyl]methanamine 1-(3,5-dibromo-4-ethoxy-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) | 4.21 | 10.13 | -108.76 | 3 | 3 | 2 | 30 | 422.205 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.21 | 8.77 | -36.22 | 2 | 3 | 1 | 26 | 421.197 | 6 | ↓ |