In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 27 | Yes |
Popular Name: 2-[4-bromo-2-[[(4-methoxyphenyl)methylamino]methyl]phenoxy]-N-tert-butyl-acetamide 2-[4-bromo-2-[[(4-methoxyphenyl)…
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) | 4.04 | 9.06 | -44.44 | 3 | 5 | 1 | 64 | 436.37 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.04 | 7.64 | -12.57 | 2 | 5 | 0 | 60 | 435.362 | 9 | ↓ |