In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 24 | Yes |
Popular Name: (1S)-1-phenyl-2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethanamine (1S)-1-phenyl-2-[4-(1,1,3,3-tetr…
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) | 4.23 | 10.1 | -44.42 | 3 | 2 | 1 | 37 | 326.504 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.23 | 9.81 | -3.41 | 2 | 2 | 0 | 35 | 325.496 | 7 | ↓ |