In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: (2R)-1-(diethylamino)-3-[[(1S)-1-(2-pyridyl)ethyl]amino]propan-2-ol (2R)-1-(diethylamino)-3-[[(1S)-1…
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) | 1.02 | 4.2 | -97.87 | 4 | 4 | 2 | 54 | 253.39 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.02 | 4.75 | -40.08 | 3 | 4 | 1 | 57 | 252.382 | 8 | ↓ |