In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2R)-2-amino-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-butanediamide (2R)-2-amino-N-[(3,4-dimethoxyph…
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) | -0.20 | -0.26 | -44.11 | 5 | 7 | 1 | 110 | 296.347 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.20 | -0.58 | -17.07 | 4 | 7 | 0 | 108 | 295.339 | 7 | ↓ |