In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2009 | 21 | Yes |
Popular Name: (2S)-4-[4-(2-diethylaminoethyloxy)phenyl]-N-ethyl-butan-2-amine (2S)-4-[4-(2-diethylaminoethylox…
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) | 3.96 | 10.39 | -78.16 | 3 | 3 | 2 | 30 | 294.483 | 11 | ↓ |
Hi High (pH 8-9.5) | 3.96 | 8.14 | -38.78 | 2 | 3 | 1 | 29 | 293.475 | 11 | ↓ |