In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2R,3R)-2-amino-N-[2-(3,5-dimethylphenoxy)ethyl]-N,3-dimethyl-pentanamide (2R,3R)-2-amino-N-[2-(3,5-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) | 2.66 | 6.59 | -44.03 | 3 | 4 | 1 | 57 | 293.431 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.66 | 6.32 | -6.69 | 2 | 4 | 0 | 56 | 292.423 | 7 | ↓ |