In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2011 | 20 | Yes |
Popular Name: (2S,4S)-2-amino-4-[4-(1,1-dimethylpropyl)phenoxy]-2-methyl-pentan-1-ol (2S,4S)-2-amino-4-[4-(1,1-dimeth…
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) | 3.87 | 4.78 | -32.51 | 4 | 3 | 1 | 57 | 280.432 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.87 | 4.45 | -4.73 | 3 | 3 | 0 | 55 | 279.424 | 7 | ↓ |