In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2009 | 18 | Yes |
Popular Name: 1-(3,4-dimethylphenyl)-2-[methyl-[(2S)-2-methylbutyl]amino]ethanone 1-(3,4-dimethylphenyl)-2-[methyl…
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 | 10.43 | -39.09 | 1 | 2 | 1 | 22 | 248.39 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.94 | 8.45 | -6.53 | 0 | 2 | 0 | 20 | 247.382 | 6 | ↓ |