In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2004 | 15 | Yes |
Popular Name: ethyl-[(2R)-3-[(2S)-3-(ethylammonio)-2-hydroxy-propoxy]-2-hydroxy-propyl]ammonium ethyl-[(2R)-3-[(2S)-3-(ethylammo…
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) | -1.37 | -1.96 | -87.43 | 6 | 5 | 2 | 83 | 222.329 | 10 | ↓ |
Hi High (pH 8-9.5) | -1.37 | -3.39 | -40.95 | 5 | 5 | 1 | 78 | 221.321 | 10 | ↓ |