In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 20 | Yes |
Popular Name: (2R)-N-[[4-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]methyl]butan-2-amine (2R)-N-[[4-(2-dimethylaminoethyl…
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) | 2.38 | 8.33 | -82.7 | 3 | 4 | 2 | 40 | 282.428 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.38 | 5.73 | -42.94 | 2 | 4 | 1 | 38 | 281.42 | 9 | ↓ |