In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 18 | Yes |
Popular Name: [3-(4-chloro-3-methylphenoxy)-2-hydroxypropyl](2-methylpropyl)amine [3-(4-chloro-3-methylphenoxy)-2-…
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) | 2.96 | 5.35 | -48.59 | 3 | 3 | 1 | 46 | 272.796 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.96 | 4.09 | -5.81 | 2 | 3 | 0 | 41 | 271.788 | 7 | ↓ |