In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2R,3R)-2-amino-N-[(3,4-dimethoxyphenyl)methyl]-N,3-dimethyl-pentanamide (2R,3R)-2-amino-N-[(3,4-dimethox…
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) | 1.20 | 4.76 | -49.1 | 3 | 5 | 1 | 66 | 295.403 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.20 | 4.48 | -10.14 | 2 | 5 | 0 | 65 | 294.395 | 7 | ↓ |