In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 16 | Yes |
Popular Name: (2S)-1-(diethylamino)-3-[[(2S)-tetrahydrofuran-2-yl]methylamino]propan-2-ol (2S)-1-(diethylamino)-3-[[(2S)-t…
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) | 0.26 | 2.93 | -97.75 | 4 | 4 | 2 | 51 | 232.368 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.26 | 1.43 | -33.32 | 3 | 4 | 1 | 46 | 231.36 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.26 | 3.46 | -41.79 | 3 | 4 | 1 | 53 | 231.36 | 8 | ↓ |