In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: (2S)-1-(diethylamino)-3-(3-morpholinopropylamino)propan-2-ol (2S)-1-(diethylamino)-3-(3-morph…
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) | 0.03 | 1.82 | -104.75 | 4 | 5 | 2 | 54 | 275.437 | 10 | ↓ |
Hi High (pH 8-9.5) | 0.03 | 0.4 | -34.41 | 3 | 5 | 1 | 49 | 274.429 | 10 | ↓ |
Mid Mid (pH 6-8) | 0.03 | 2.34 | -44.21 | 3 | 5 | 1 | 57 | 274.429 | 10 | ↓ |
Lo Low (pH 4.5-6) | 0.03 | 4.09 | -183.12 | 5 | 5 | 3 | 55 | 276.445 | 10 | ↓ |