In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: 3-[[[(1R)-2-(4-bromophenyl)-1-methyl-ethyl]amino]methyl]phenol 3-[[[(1R)-2-(4-bromophenyl)-1-me…
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) | 3.94 | 6.34 | -5.03 | 2 | 2 | 0 | 32 | 320.23 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.94 | 7.38 | -44.4 | 3 | 2 | 1 | 37 | 321.238 | 5 | ↓ |